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Substance Name: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-3-(4-methoxyphenyl)-9-methyl-2-phenyl-
RN: 56071-26-2
InChIKey: MJWDABBBYMCJKM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H22-N2-O2

Molecular Weight

  • 382.4608
 
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Names and Synonyms

Synonyms

  • 2-Phenyl-3-(p-methoxyphenyl)-2,3,3a-trihydro-9-methyl-(1)benzoxepino(5,4-c)pyrazole
  • BRN 1043012

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 56071-26-2

System Generated Number

  • 0056071262

Structure Descriptors

InChI

1S/C25H22N2O2/c1-17-8-13-23-22(16-17)24-21(14-15-29-23)25(18-9-11-20(28-2)12-10-18)27(26-24)19-6-4-3-5-7-19/h3-13,16H,14-15H2,1-2H3

InChIKey

MJWDABBBYMCJKM-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)-c3c(c(n(n3)c4ccccc4)c5ccc(cc5)OC)CCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Indian Journal of Chemistry. Vol. 13, Pg. 1, 1975.