NS-398: Difference between revisions

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Revision as of 12:28, 19 April 2011 editCheMoBot (talk \| contribs)Bots141,565 edits Updating {{chembox}} (no changed fields - added verified revid - updated 'UNII_Ref', 'ChemSpiderID_Ref', 'StdInChI_Ref', 'StdInChIKey_Ref', 'ChEMBL_Ref', 'KEGG_Ref') per Chem/Drugbox validation (← Previous edit		Latest revision as of 19:36, 31 January 2024 edit undoMichael7604 (talk \| contribs)Extended confirmed users8,895 edits recategorized from Nitrobenzenes to Nitrobenzene derivatives
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	{{chembox		{{chembox
			\| Verifiedfields = changed
⚫	\| verifiedrevid = ~~400465036~~
			\| Watchedfields = changed
	\|Reference=<ref> at ]</ref>
		⚫	\| verifiedrevid = 424846904
⚫	\|ImageFile=NS-398.png
			\| Reference=
⚫	\|ImageSize=180px
		⚫	\| ImageFile=NS-398.png
⚫	\|~~IUPACName~~=''N''-methanesulfonamide
		⚫	\| ImageSize=180px
⚫	\|OtherNames=
			\| ImageFile1 = NS-398 molecule spacefill.png
			\| ImageAlt1 = Space-filling model of the NS-398 molecule
		⚫	\| PIN=''N''-methanesulfonamide
		⚫	\| OtherNames=
	\|Section1={{Chembox Identifiers		\|Section1={{Chembox Identifiers
			\| CASNo_Ref = {{cascite\|correct\|CAS}}
	\| CASNo=123653-11-2		\| CASNo=123653-11-2
⚫	\| PubChem=4553
			\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
⚫	\| SMILES=CS(=O)(=O)NC1=C(C=C(C=C1)(=O))OC2CCCCC2
			\| ChEBI = 73458
			\| ChEMBL = 7162
			\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
			\| ChemSpiderID = 4393
			\| DrugBank = DB14060
			\| IUPHAR_ligand = 8976
		⚫	\| PubChem=4553
			\| InChI = 1/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
			\| InChIKey = KTDZCOWXCWUPEO-UHFFFAOYAY
			\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
			\| StdInChI = 1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
			\| StdInChIKey_Ref = {{stdinchicite\|changed\|chemspider}}
			\| StdInChIKey = KTDZCOWXCWUPEO-UHFFFAOYSA-N
		⚫	\| SMILES=CS(=O)(=O)NC1=C(C=C(C=C1)(=O))OC2CCCCC2
	}}		}}
	\|Section2={{Chembox Properties		\|Section2={{Chembox Properties
	\| C=13\|H=18\|N=2\|O=5\|S=1		\| C=13 \| H=18 \| N=2 \| O=5 \| S=1
	\| Appearance=Off-white solid		\| Appearance=Off-white solid
	\| Density=		\| Density=
	\| MeltingPt=		\| MeltingPt=
	\| BoilingPt=		\| BoilingPt=
	\| Solubility=Insoluble		\| Solubility=Insoluble
	\| SolubleOther = 5 mg/mL		\| SolubleOther = 5 mg/mL
	\| Solvent = ]		\| Solvent = ]
	\|
	}}		}}
	\|Section3={{Chembox Hazards		\|Section3={{Chembox Hazards
	\| MainHazards=		\| MainHazards=
	\| FlashPt=		\| FlashPt=
			\| AutoignitionPt =
	\| Autoignition=
			\| GHS_ref=<ref>{{cite web \|title=N194 NS-398 \|url=https://www.sigmaaldrich.com/AU/en/product/sigma/n194 \|publisher=Sigma-Aldrich \|access-date=13 December 2021}}</ref>
	\| RPhrases =
	\| ~~SPhrases~~ = {{~~S22}} {{S24/25~~}}		\| GHSPictograms = {{GHS07}}
			\| GHSSignalWord = Warning
			\| HPhrases = {{H-phrases\|302\|312\|332}}
			\| PPhrases = {{P-phrases\|280}}
	}}		}}
	}}		}}

	'''NS-398''' is a ] used in the study of the function of ]s.<ref>~~See for example:~~ {{cite journal \| journal = American Journal of Pathology \| year = 2005 \| volume = 167 \| issue = 4 \| pages = 1105–1117 \| title = NS-398, a Cyclooxygenase-2-Specific Inhibitor, Delays Skeletal Muscle Healing by Decreasing Regeneration and Promoting Fibrosis \| ~~author~~ = Wei Shen, Yong Li, Ying Tang, James Cummins ~~and~~ Johnny Huard \| pmid = 16192645 \| pmc = 1603662}}</ref>		'''NS-398''' is a ] used in the study of the function of ]s.<ref>{{cite journal \| journal = American Journal of Pathology \| year = 2005 \| volume = 167 \| issue = 4 \| pages = 1105–1117 \| title = NS-398, a Cyclooxygenase-2-Specific Inhibitor, Delays Skeletal Muscle Healing by Decreasing Regeneration and Promoting Fibrosis \|author1=Wei Shen \|author2=Yong Li \|author3=Ying Tang \|author4=James Cummins \|author5=Johnny Huard \| pmid = 16192645 \| pmc = 1603662 \| doi = 10.1016/S0002-9440(10)61199-6}}</ref>

			==See also==
			*]
			*] (JTE-522)

	==References==		==References==
	{{~~reflist~~}}		{{Reflist}}

			{{Prostanoidergics}}

	]		]
	]		]
			]
	]		]
			]
			]

	{{Organic-compound-stub}}		{{Organic-compound-stub}}

Latest revision as of 19:36, 31 January 2024

NS-398
Names


Preferred IUPAC name N-methanesulfonamide
Identifiers
CAS Number	123653-11-2
3D model (JSmol)	Interactive image
ChEBI	CHEBI:73458
ChEMBL	ChEMBL7162
ChemSpider	4393
DrugBank	DB14060
IUPHAR/BPS	8976
PubChem CID	4553
CompTox Dashboard (EPA)	DTXSID8041084
InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3Key: KTDZCOWXCWUPEO-UHFFFAOYSA-N InChI=1/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3Key: KTDZCOWXCWUPEO-UHFFFAOYAY
SMILES CS(=O)(=O)NC1=C(C=C(C=C1)(=O))OC2CCCCC2
Properties
Chemical formula	C₁₃H₁₈N₂O₅S
Molar mass	314.36 g·mol
Appearance	Off-white solid
Solubility in water	Insoluble
Solubility in DMSO	5 mg/mL
Hazards
GHS labelling:
Pictograms
Signal word	Warning
Hazard statements	H302, H312, H332
Precautionary statements	P280
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). N verify (what is ?) Infobox references

Chemical compound

NS-398 is a COX-2 inhibitor used in the study of the function of cyclooxygenases.

References

"N194 NS-398". Sigma-Aldrich. Retrieved 13 December 2021.
Wei Shen; Yong Li; Ying Tang; James Cummins; Johnny Huard (2005). "NS-398, a Cyclooxygenase-2-Specific Inhibitor, Delays Skeletal Muscle Healing by Decreasing Regeneration and Promoting Fibrosis". American Journal of Pathology. 167 (4): 1105–1117. doi:10.1016/S0002-9440(10)61199-6. PMC 1603662. PMID 16192645.

Prostanoid signaling modulators

Receptor
(ligands)

DP (D₂)Tooltip Prostaglandin D2 receptor

DP₁Tooltip Prostaglandin D2 receptor 1

Agonists: Prostaglandin D₂
Treprostinil

DP₂Tooltip Prostaglandin D2 receptor 2

Agonists: Indometacin
Prostaglandin D₂

EP (E₂)Tooltip Prostaglandin E2 receptor

EP₁Tooltip Prostaglandin EP1 receptor	Agonists: Beraprost Enprostil Iloprost (ciloprost) Latanoprost Lubiprostone Misoprostol Prostaglandin E₁ (alprostadil) Prostaglandin E₂ (dinoprostone) Sulprostone Antagonists: AH-6809 ONO-8130 SC-19220 SC-51089 SC-51322
EP₂Tooltip Prostaglandin EP2 receptor	Agonists: Butaprost Misoprostol Prostaglandin E₁ (alprostadil) Prostaglandin E₂ (dinoprostone) Treprostinil Antagonists: AH-6809 PF-04418948 TG 4-155
EP₃Tooltip Prostaglandin EP3 receptor	Agonists: Beraprost Carbacyclin Cicaprost Enprostil Iloprost (ciloprost) Isocarbacyclin Latanoprost Misoprostol Prostaglandin D₂ Prostaglandin E₁ (alprostadil) Prostaglandin E₂ (dinoprostone) Remiprostol Ricinoleic acid Sulprostone Antagonists: L-798106
EP₄Tooltip Prostaglandin EP4 receptor	Agonists: Lubiprostone Misoprostol Prostaglandin E₁ (alprostadil) Prostaglandin E₂ (dinoprostone) TCS-2510 Antagonists: Grapiprant GW-627368 L-161982 ONO-AE3-208
Unsorted	Agonists: 16,16-Dimethyl Prostaglandin E₂ Aganepag Carboprost Evatanepag Gemeprost Nocloprost Omidenepag Prostaglandin F_2α (dinoprost) Simenepag Taprenepag

FP (F_2α)Tooltip Prostaglandin F receptor

IP (I₂)Tooltip Prostacyclin receptor

Agonists: ACT-333679
AFP-07
Beraprost
BMY-45778
Carbacyclin
Cicaprost
Iloprost (ciloprost)
Isocarbacyclin
MRE-269
NS-304
Prostacyclin (prostaglandin I₂, epoprostenol)
Prostaglandin E₁ (alprostadil)
Ralinepag
Selexipag
Taprostene
TRA-418
Treprostinil

Antagonists: RO1138452

TP (TX_A2)Tooltip Thromboxane receptor

Agonists: Carbocyclic thromboxane A₂
I-BOP
Thromboxane A₂
U-46619
Vapiprost

Unsorted

Enzyme
(inhibitors)

COX (PTGS)	Salicylic acids: Aloxiprin Aspirin (acetylsalicylic acid) Benorilate (benorylate) Carbasalate calcium Diflunisal Dipyrocetyl Ethenzamide Guacetisal Magnesium salicylate Mesalazine (5-aminosalicylic acid) Methyl salicylate Salacetamide Salicin Salicylamide Salicylate (salicylic acid) Salsalate Sodium salicylate Triflusal; Acetic acids: Aceclofenac Acemetacin Aclofenac Amfenac Alclofenac Bendazac Bromfenac Bufexamac Bumadizone Cinmetacin Clometacin Diclofenac Difenpiramide Etodolac Felbinac Fenclofenac Fentiazac Glucametacin Indometacin (indomethacin) Indometacin farnesil Ketorolac Lonazolac Mofezolac Nabumetone Oxametacin Oxindanac Proglumetacin Sulindac Sulindac sulfide Tolmetin Zidometacin Zomepirac; Propionic acids: Alminoprofen Benoxaprofen Bucloxic acid (blucloxate) Butibufen Carprofen Dexibuprofen Dexindoprofen Dexketoprofen Fenbufen Fenoprofen Flunoxaprofen Flurbiprofen Ibuprofen Ibuproxam Indoprofen Ketoprofen Loxoprofen Miroprofen Naproxen Naproxcinod Oxaprozin Pirprofen Pranoprofen Suprofen Tarenflurbil Tepoxalin Tiaprofenic acid (tiaprofenate) Vedaprofen; Anthranilic acids (fenamic acids): Etofenamic acid (etofenamate) Floctafenic acid (floctafenate) Flufenamic acid (flufenamate) Meclofenamic acid (meclofenamate) Mefenamic acid (mefenamate) Morniflumic acid (morniflumate) Niflumic acid (niflumate) Talinflumic acid (talinflumate) Tolfenamic acid (tolfenamate); Pyrazolones: Azapropazone Dipyrone Isopyrin Oxyphenbutazone Phenylbutazone; Enolic acids (oxicams): Ampiroxicam Droxicam Enolicam Isoxicam Lornoxicam Meloxicam Piroxicam Tenoxicam; 4-Aminoquinolines: Antrafenine Floctafenine Glafenine; Quinazolines: Fluproquazone Proquazone; Aminonicotinic acids: Clonixeril Clonixin Flunixin; Sulfonanilides: Flosulide Nimesulide; Aminophenols (anilines): Acetanilide AM-404 (N-arachidonoylaminophenol) Bucetin Paracetamol (acetaminophen) Parapropamol Phenacetin Propacetamol; Selective COX-2 inhibitors (coxibs): Apricoxib Celecoxib Cimicoxib Deracoxib Etoricoxib Firocoxib Lumiracoxib Mavacoxib Parecoxib Polmacoxib Robenacoxib Rofecoxib Tilmacoxib Valdecoxib; Others/unsorted: Anitrazafen Clobuzarit Curcumin DuP-697 FK-3311 Flumizole FR-122047 Glimepiride Hyperforin Itazigrel L-655240 L-670596 Licofelone Menatetrenone (vitamin K₂) NCX-466 NCX-4040 NS-398 Pamicogrel Resveratrol Romazarit Rosmarinic acid Rutecarpine Satigrel SC-236 SC-560 SC-58125 Tenidap Tiflamizole Timegadine Trifenagrel Tropesin
PGD₂STooltip Prostaglandin D synthase	Retinoids Selenium (selenium tetrachloride, sodium selenite, selenium disulfide)
PGESTooltip Prostaglandin E synthase	HQL-79
PGFSTooltip Prostaglandin F synthase	Bimatoprost
PGI₂STooltip Prostacyclin synthase	Tranylcypromine
TXASTooltip Thromboxane A synthase	Camonagrel Dazmegrel Dazoxiben Furegrelate Isbogrel Midazogrel Nafagrel Nicogrelate Ozagrel Picotamide Pirmagrel Ridogrel Rolafagrel Samixogrel Terbogrel U63557A

Others

See also: Receptor/signaling modulators; Leukotriene signaling modulators

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Latest revision as of 19:36, 31 January 2024

See also

References