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Substance Name: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(2-hydroxyethoxy)-1-methyl-5-phenyl-
RN: 40966-99-2
InChIKey: PYRIRQPKPPLVMI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-Cl-N2-O3

Molecular Weight

  • 344.7963
 
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Names and Synonyms

Synonyms

  • 5-25-02-00243 (Beilstein Handbook Reference)
  • 7-Chloro-1,3-dihydro-3-(2-hydroxyethoxy)-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one
  • BRN 0703078

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(2-hydroxyethoxy)-1-methyl-5-phenyl-

Registry Numbers

CAS Registry Number

  • 40966-99-2

System Generated Number

  • 0040966992

Structure Descriptors

InChI

1S/C18H17ClN2O3/c1-21-15-8-7-13(19)11-14(15)16(12-5-3-2-4-6-12)20-17(18(21)23)24-10-9-22/h2-8,11,17,22H,9-10H2,1H3

InChIKey

PYRIRQPKPPLVMI-UHFFFAOYSA-N

Smiles

CN1c2ccc(cc2C(=NC(C1=O)OCCO)c3ccccc3)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 5986mg/kg (5986mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1093, 1979.