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Substance Name: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-fluorophenyl)-1-(4-piperidinyl)-, monohydrobromide
RN: 93592-57-5
InChIKey: KJHDHBTYNZAATG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-Cl-F-N3-O.Br-H

Molecular Weight

  • 452.753
 
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Names and Synonyms

Synonym

  • 7-Chloro-1,3-dihydro-5-(2-fluorophenyl)-1-(4-piperidinyl)-2H-1,4-benzodiazepin-2-one HBr

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-fluorophenyl)-1-(4-piperidinyl)-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 93592-57-5

System Generated Number

  • 0093592575

Molecular Formulas

Molecular Formula

  • C20-H19-Cl-F-N3-O.Br-H

Molecular Formula Fragments

  • Br-H
  • C20-H19-Cl-F-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C20H19ClFN3O.BrH/c21-13-5-6-18-16(11-13)20(15-3-1-2-4-17(15)22)24-12-19(26)25(18)14-7-9-23-10-8-14;/h1-6,11,14,23H,7-10,12H2;1H

InChIKey

KJHDHBTYNZAATG-UHFFFAOYSA-N

Smiles

Br.Fc1ccccc1C2=NCC(=O)N(C3CCNCC3)c4ccc(Cl)cc24

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 200mg/kg (200mg/kg)   United States Patent Document. Vol. #4560684,