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Substance Name: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-3-(4-chlorophenyl)-9-methyl-
RN: 124392-74-1
InChIKey: ZGVKNLFQRXPKEC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-Cl-N2-O

Molecular Weight

  • 310.7825
 
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Names and Synonyms

Synonyms

  • 4,5-Dihydro-3-(4-chlorophenyl)-9-methyl-2H-(1)benzoxepino(5,4-c)pyrazole
  • BRN 4523013

Systematic Name

  • 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-3-(4-chlorophenyl)-9-methyl-

Registry Numbers

CAS Registry Number

  • 124392-74-1

System Generated Number

  • 0124392741

Structure Descriptors

InChI

1S/C18H15ClN2O/c1-11-2-7-16-15(10-11)18-14(8-9-22-16)17(20-21-18)12-3-5-13(19)6-4-12/h2-7,10H,8-9H2,1H3,(H,20,21)

InChIKey

ZGVKNLFQRXPKEC-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)-c3c(c([nH]n3)c4ccc(cc4)Cl)CCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 825mg/kg (825mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 28, Pg. 37, 1989.