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Substance Name: Pyrazino(1,2-a)(1,4)benzodiazepine-4-carboxylic acid, 1,2,3,5-tetrahydro-9-chloro-7-(2-chlorophenyl)-2-oxo-, methyl ester
RN: 87216-19-1
InChIKey: MZRNMXSAXVXTLG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H15-Cl2-N3-O3

Molecular Weight

  • 416.2625
 
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Names and Synonyms

Synonym

  • BRN 4592753

Systematic Name

  • Pyrazino(1,2-a)(1,4)benzodiazepine-4-carboxylic acid, 1,2,3,5-tetrahydro-9-chloro-7-(2-chlorophenyl)-2-oxo-, methyl ester

Registry Numbers

CAS Registry Number

  • 87216-19-1

System Generated Number

  • 0087216191

Structure Descriptors

InChI

1S/C20H15Cl2N3O3/c1-28-20(27)19-16-9-23-18(12-4-2-3-5-14(12)22)13-8-11(21)6-7-15(13)25(16)10-17(26)24-19/h2-8H,9-10H2,1H3,(H,24,26)

InChIKey

MZRNMXSAXVXTLG-UHFFFAOYSA-N

Smiles

COC(=O)C1=C2CN=C(c3cc(ccc3N2CC(=O)N1)Cl)c4ccccc4Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Heterocyclic Chemistry. Vol. 20, Pg. 791, 1983.