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Substance Name: 2H-(1,5)-Benzodiazepin-2-one, 1,3-dihydro-4-amino-1-phenyl-8-(trifluoromethyl)-
RN: 36985-35-0
InChIKey: VRAXKPZRHYDZFB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H12-F3-N3-O

Molecular Weight

  • 319.285
 
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Names and Synonyms

Synonyms

  • 4-Amino-1-phenyl-8-(trifluoromethyl)-2H-1,3-dihydro-(1,5)-benzodiazepin-2-one
  • 5-25-15-00138 (Beilstein Handbook Reference)
  • BRN 0895455

Systematic Name

  • 2H-(1,5)-Benzodiazepin-2-one, 1,3-dihydro-4-amino-1-phenyl-8-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 36985-35-0

System Generated Number

  • 0036985350

Structure Descriptors

InChI

1S/C16H12F3N3O/c17-16(18,19)10-6-7-12-13(8-10)22(11-4-2-1-3-5-11)15(23)9-14(20)21-12/h1-8H,9H2,(H2,20,21)

InChIKey

VRAXKPZRHYDZFB-UHFFFAOYSA-N

Smiles

c12N(c3ccccc3)C(CC(=Nc1ccc(c2)C(F)(F)F)N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2066mg/kg (2066mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 1011, 1973.