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Substance Name: Acetophenone, 4'-(2-hydroxy-3-(4-phenylpiperazinyl)propoxy)-3'-methyl-
RN: 63990-50-1
InChIKey: WMHPFELNGHYGPL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O3

Molecular Weight

  • 368.474
 
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Names and Synonyms

Synonyms

  • 1-(4-Acetyl-2-methylphenoxy)-3-(4-phenylpiperazinyl)propan-2-ol
  • 5-23-02-00114 (Beilstein Handbook Reference)
  • BRN 0578162

Systematic Name

  • Acetophenone, 4'-(2-hydroxy-3-(4-phenylpiperazinyl)propoxy)-3'-methyl-

Registry Numbers

CAS Registry Number

  • 63990-50-1

System Generated Number

  • 0063990501

Structure Descriptors

InChI

1S/C22H28N2O3/c1-17-14-19(18(2)25)8-9-22(17)27-16-21(26)15-23-10-12-24(13-11-23)20-6-4-3-5-7-20/h3-9,14,21,26H,10-13,15-16H2,1-2H3

InChIKey

WMHPFELNGHYGPL-UHFFFAOYSA-N

Smiles

N1(c2ccccc2)CCN(C[C@@H](COc2c(cc(C(C)=O)cc2)C)O)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Journal of Medicinal Chemistry. Vol. 15, Pg. 286, 1972.