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Substance Name: 1-Piperazinecarboxylic acid, 4-(1-phenyl-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepin-5-yl)-, ethyl ester
RN: 137731-23-8
InChIKey: SAFGFUBGKLXAJW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H24-N6-O2

Molecular Weight

  • 416.4826
 
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Names and Synonyms

Synonym

  • BRN 4828939

Systematic Name

  • 1-Piperazinecarboxylic acid, 4-(1-phenyl-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepin-5-yl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 137731-23-8

System Generated Number

  • 0137731238

Structure Descriptors

InChI

1S/C23H24N6O2/c1-2-31-23(30)28-14-12-27(13-15-28)20-16-21-25-26-22(17-8-4-3-5-9-17)29(21)19-11-7-6-10-18(19)24-20/h3-11H,2,12-16H2,1H3

InChIKey

SAFGFUBGKLXAJW-UHFFFAOYSA-N

Smiles

CCOC(=O)N1CCN(CC1)C2=Nc3ccccc3-n4c(nnc4c5ccccc5)C2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 620mg/kg (620mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 489, 1991.