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Substance Name: 1-Piperazinecarboxaldehyde, 4-((8-chloro-1-oxo-6-phenyl-1H-imidazo(1,2-a)(1,4)benzodiazepin-2(4H)-ylidene)methyl)-
RN: 63146-61-2
InChIKey: ABEXNVZPPKWUGG-XMHGGMMESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H20-Cl-N5-O2

Molecular Weight

  • 433.897
 
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Names and Synonyms

Synonym

  • BRN 0865579

Systematic Name

  • 1-Piperazinecarboxaldehyde, 4-((8-chloro-1-oxo-6-phenyl-1H-imidazo(1,2-a)(1,4)benzodiazepin-2(4H)-ylidene)methyl)-

Registry Numbers

CAS Registry Number

  • 63146-61-2

System Generated Number

  • 0063146612

Structure Descriptors

InChI

1S/C23H20ClN5O2/c24-17-6-7-20-18(12-17)22(16-4-2-1-3-5-16)25-13-21-26-19(23(31)29(20)21)14-27-8-10-28(15-30)11-9-27/h1-7,12,14-15H,8-11,13H2/b19-14+

InChIKey

ABEXNVZPPKWUGG-XMHGGMMESA-N

Smiles

c1ccc(cc1)C2=NCC3=N/C(=C/N4CCN(CC4)C=O)/C(=O)N3c5c2cc(cc5)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1035, 1977.