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Substance Name: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-hydroxy-1-methyl-5-phenyl-, trichloroacetate
RN: 40967-07-5
InChIKey: SRXPVAFPZMREOY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H12-Cl4-N2-O3

Molecular Weight

  • 446.116
 
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Names and Synonyms

Synonyms

  • 5-25-02-00243 (Beilstein Handbook Reference)
  • 7-Chloro-1,3-dihydro-3-hydroxy-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one trichloroacetate
  • BRN 0720821

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-hydroxy-1-methyl-5-phenyl-, trichloroacetate

Registry Numbers

CAS Registry Number

  • 40967-07-5

System Generated Number

  • 0040967075

Structure Descriptors

InChI

1S/C18H12Cl4N2O3/c1-24-13-8-7-11(19)9-12(13)14(10-5-3-2-4-6-10)23-15(16(24)25)27-17(26)18(20,21)22/h2-9,15H,1H3

InChIKey

SRXPVAFPZMREOY-UHFFFAOYSA-N

Smiles

c12C(c3ccccc3)=N[C@@H](OC(C(Cl)(Cl)Cl)=O)C(N(c1ccc(c2)Cl)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2486mg/kg (2486mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1093, 1979.