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Substance Name: 1H-1,5-Benzodiazepine-2-carboxylic acid, 2,3,4,5-tetrahydro-2-methyl-5-(1-oxo-3-phenyl-2-propentyl)-4-phenyl-, ethyl ester
RN: 144401-01-4
InChIKey: QBKZGEPHBARBRF-VHEBQXMUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H28-N2-O3

Molecular Weight

  • 440.5402
 
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Names and Synonyms

  • 1H-1,5-Benzodiazepine-2-carboxylic acid, 2,3,4,5-tetrahydro-2-methyl-5-(1-oxo-3-phenyl-2-propentyl)-4-phenyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 144401-01-4

System Generated Number

  • 0144401014

Structure Descriptors

InChI

1S/C28H28N2O3/c1-3-33-27(32)28(2)20-25(22-14-8-5-9-15-22)30(24-17-11-10-16-23(24)29-28)26(31)19-18-21-12-6-4-7-13-21/h4-19,25,29H,3,20H2,1-2H3/b19-18+

InChIKey

QBKZGEPHBARBRF-VHEBQXMUSA-N

Smiles

CCOC(=O)C1(CC(N(c2ccccc2N1)C(=O)/C=C/c3ccccc3)c4ccccc4)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 495, 1991.
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 495, 1991.