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Substance Name: Acetophenone, 2-(1-imidazolyl)-2'-phenyl-, hydrochloride
RN: 77234-74-3
InChIKey: KGTSTXQDZSKHEQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-N2-O.Cl-H

Molecular Weight

  • 298.772
 
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Names and Synonyms

Synonym

  • N-((2-Phenylbenzoyl)methyl)imidazole hydrochloride

Systematic Name

  • Acetophenone, 2-(1-imidazolyl)-2'-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 77234-74-3

System Generated Number

  • 0077234743

Molecular Formulas

Molecular Formula

  • C17-H14-N2-O.Cl-H

Molecular Formula Fragments

  • C17-H14-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H14N2O.ClH/c20-17(12-19-11-10-18-13-19)16-9-5-4-8-15(16)14-6-2-1-3-7-14;/h1-11,13H,12H2;1H

InChIKey

KGTSTXQDZSKHEQ-UHFFFAOYSA-N

Smiles

c1(c(C(C[N+]2C=CN=C2)=O)cccc1)c1ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 115mg/kg (115mg/kg) BEHAVIORAL: ANTICONVULSANT Journal of Medicinal Chemistry. Vol. 24, Pg. 727, 1981.
mouse LD50 oral 360mg/kg (360mg/kg) BEHAVIORAL: ANTICONVULSANT Journal of Medicinal Chemistry. Vol. 24, Pg. 727, 1981.