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Substance Name: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-2-phenyl-
RN: 124392-75-2
InChIKey: WFRNUOVWNCRHCA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H22-N2-O

Molecular Weight

  • 366.4618
 
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Names and Synonyms

Synonyms

  • 4,5-Dihydro-9-methyl-3-(4-methylphenyl)-2-phenyl-2H-(1)benzoxepino(5,4-c)pyrazole
  • BRN 4568772

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 124392-75-2

System Generated Number

  • 0124392752

Structure Descriptors

InChI

1S/C25H22N2O/c1-17-8-11-19(12-9-17)25-21-14-15-28-23-13-10-18(2)16-22(23)24(21)26-27(25)20-6-4-3-5-7-20/h3-13,16H,14-15H2,1-2H3

InChIKey

WFRNUOVWNCRHCA-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2c3c(nn2c4ccccc4)-c5cc(ccc5OCC3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 28, Pg. 37, 1989.