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Substance Name: Spiro(benzo(b)cyclopenta(e)(1,4)diazepine-10(9H),1'-cyclopentane)-9-ethanamine, 1,2,3,10a-tetrahydro-N-(4-methoxyphenyl)-
RN: 133307-93-4
InChIKey: BWAQGCRALANEEP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N3-O

Molecular Weight

  • 389.5399
 
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Names and Synonyms

Synonym

  • BRN 4335453

Systematic Name

  • Spiro(benzo(b)cyclopenta(e)(1,4)diazepine-10(9H),1'-cyclopentane)-9-ethanamine, 1,2,3,10a-tetrahydro-N-(4-methoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 133307-93-4

System Generated Number

  • 0133307934

Structure Descriptors

InChI

InChI=1S/C25H31N3O/c1-29-20-13-11-19(12-14-20)26-17-18-28-24-10-3-2-8-23(24)27-22-9-6-7-21(22)25(28)15-4-5-16-25/h2-3,8,10-14,21,26H,4-7,9,15-18H2,1H3

InChIKey

BWAQGCRALANEEP-UHFFFAOYSA-N

Smiles

COc1ccc(NCCN2c3ccccc3N=C4CCCC4C25CCCC5)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 41, Pg. 101, 1991.