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Revision as of 13:36, 23 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 456763178 of page Mechlorethamine for the Chem/Drugbox validation project (updated: 'DrugBank').← Previous edit Revision as of 13:37, 23 November 2011 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 456625304 of page Mecloqualone for the Chem/Drugbox validation project (updated: 'CAS_number').Next edit →
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{{ambox | text = This page contains a copy of the infobox ({{tl|drugbox}}) taken from revid of page ] with values updated to verified values.}} {{ambox | text = This page contains a copy of the infobox ({{tl|drugbox}}) taken from revid of page ] with values updated to verified values.}}
{{Drugbox {{Drugbox
| Verifiedfields = changed | Verifiedfields = changed
| verifiedrevid = 394752350 | verifiedrevid = 408583744
| IUPAC_name = 2-chloro-N-(2-chloroethyl)-N-methyl-ethanamine | IUPAC_name = 3-(2-chlorophenyl)-2-methylquinazolin-4(3''H'')-one
| image = Mechlorethamine.png | image = mecloqualone.png
| width = 170 | width = 140


<!--Clinical data--> <!--Clinical data-->
| tradename = | tradename =
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| Drugs.com = {{drugs.com|CDI|mechlorethamine}}
| pregnancy_US = <!-- A / B / C / D / X -->
| MedlinePlus = a682223
| pregnancy_category = D <small>(US)</small> | pregnancy_category =
| legal_AU = <!-- Unscheduled / S2 / S3 / S4 / S5 / S6 / S7 / S8 / S9 -->
⚫ | legal_status = Rx-only
| legal_CA = <!-- / Schedule I, II, III, IV, V, VI, VII, VIII -->
| routes_of_administration = IV, intracavitary, intrapericardially, topical
| legal_UK = <!-- GSL / P / POM / CD / Class A, B, C -->
| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V -->
⚫ | legal_status =
| routes_of_administration =


<!--Pharmacokinetic data--> <!--Pharmacokinetic data-->
| bioavailability = ? | bioavailability =
| protein_bound =
| metabolism = Rapid hydrolysis and demethylation, possibly in plasma
| metabolism =
| elimination_half-life = < 1 minute | elimination_half-life =
| excretion = Urine (50% as metabolites, <0.01% as unchanged drug)
| excretion =


<!--Identifiers--> <!--Identifiers-->
| CASNo_Ref = {{cascite|correct|CAS}}
| CAS_number_Ref = {{cascite|correct|??}} | CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = 51-75-2 | CAS_number = <!-- blanked - oldvalue: 340-57-8 -->
| ATC_prefix = L01 | ATC_prefix = none
| ATC_suffix = AA05 | ATC_suffix =
| PubChem = 4033 | PubChem = 9567
| DrugBank_Ref = {{drugbankcite|correct|drugbank}} | DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank = DB00888 | DrugBank =
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID = 3893 | ChemSpiderID = 9192
| UNII_Ref = {{fdacite|correct|FDA}} | UNII_Ref = {{fdacite|changed|FDA}}
| UNII = 50D9XSG0VR | UNII = 09XU4VDV7E
| ChEBI_Ref = {{ebicite|changed|EBI}} | KEGG_Ref = {{keggcite|correct|kegg}}
| ChEBI = 28925 | KEGG = D04877
| ChEMBL_Ref = {{ebicite|changed|EBI}} | ChEMBL_Ref = {{ebicite|correct|EBI}}
| ChEMBL = 427 | ChEMBL = 279960


<!--Chemical data--> <!--Chemical data-->
| C=5 | H=11 | Cl=2 | N=1 | C=15 | H=11 | Cl=1 | N=2 | O=1
| molecular_weight = 156.055 g mol<sup>−1</sup> | molecular_weight = 270.714
| smiles = ClCCN(CCCl)C | smiles = Clc3ccccc3N/1C(=O)c2c(\N=C\1C)cccc2
| InChI = 1/C15H11ClN2O/c1-10-17-13-8-4-2-6-11(13)15(19)18(10)14-9-5-3-7-12(14)16/h2-9H,1H3
⚫ | StdInChI_Ref = {{stdinchicite|changed|chemspider}}
| InChIKey = SFITWQDBYUMAPS-UHFFFAOYAG
⚫ | StdInChI = 1S/C5H11Cl2N/c1-8(4-2-6)5-3-7/h2-5H2,1H3
| StdInChIKey_Ref = {{stdinchicite|changed|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
⚫ | StdInChI = 1S/C15H11ClN2O/c1-10-17-13-8-4-2-6-11(13)15(19)18(10)14-9-5-3-7-12(14)16/h2-9H,1H3
⚫ | StdInChIKey = HAWPXGHAZFHHAD-UHFFFAOYSA-N
⚫ | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
⚫ | StdInChIKey = SFITWQDBYUMAPS-UHFFFAOYSA-N
}} }}

Revision as of 13:37, 23 November 2011

This page contains a copy of the infobox ({{drugbox}}) taken from revid 456625304 of page Mecloqualone with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Clinical data
ATC code
  • none
Identifiers
IUPAC name
  • 3-(2-chlorophenyl)-2-methylquinazolin-4(3H)-one
PubChem CID
ChemSpider
UNII
KEGG
ChEMBL
Chemical and physical data
FormulaC15H11ClN2O
Molar mass270.714 g·mol
3D model (JSmol)
SMILES
  • Clc3ccccc3N/1C(=O)c2c(\N=C\1C)cccc2
InChI
  • InChI=1S/C15H11ClN2O/c1-10-17-13-8-4-2-6-11(13)15(19)18(10)14-9-5-3-7-12(14)16/h2-9H,1H3
  • Key:SFITWQDBYUMAPS-UHFFFAOYSA-N
  (what is this?)  (verify)