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Substance Name: 1-Piperazinecarboxylic acid, 4-(1-methyl-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepin-5-yl)-, ethyl ester
RN: 137731-18-1
InChIKey: ZBJWQWIJEKQRFO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-N6-O2

Molecular Weight

  • 354.4118
 
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Names and Synonyms

Synonym

  • BRN 4825674

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 137731-18-1

System Generated Number

  • 0137731181

Structure Descriptors

InChI

1S/C18H22N6O2/c1-3-26-18(25)23-10-8-22(9-11-23)16-12-17-21-20-13(2)24(17)15-7-5-4-6-14(15)19-16/h4-7H,3,8-12H2,1-2H3

InChIKey

ZBJWQWIJEKQRFO-UHFFFAOYSA-N

Smiles

CCOC(=O)N1CCN(CC1)C2=Nc3ccccc3-n4c(nnc4C2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 800mg/kg (800mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 489, 1991.