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Substance Name: 1-Propanone, 1-(4-(3-(4-(2-chlorophenyl)-1-piperazinyl)-2-hydroxypropoxy)phenyl)-, (+-)-
RN: 36115-83-0
InChIKey: VQNHMUVKVPDNBQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-Cl-N2-O3

Molecular Weight

  • 402.919
 
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Names and Synonyms

Synonyms

  • (+-)-1-(4-(3-(4-(2-Chlorophenyl)-1-piperazinyl)-2-hydroxypropoxy)phenyl)-1-propanone
  • BRN 0584298

Systematic Name

  • 1-Propanone, 1-(4-(3-(4-(2-chlorophenyl)-1-piperazinyl)-2-hydroxypropoxy)phenyl)-, (+-)-

Registry Numbers

CAS Registry Number

  • 36115-83-0

System Generated Number

  • 0036115830

Structure Descriptors

InChI

1S/C22H27ClN2O3/c1-2-22(27)17-7-9-19(10-8-17)28-16-18(26)15-24-11-13-25(14-12-24)21-6-4-3-5-20(21)23/h3-10,18,26H,2,11-16H2,1H3

InChIKey

VQNHMUVKVPDNBQ-UHFFFAOYSA-N

Smiles

C(CC)(=O)c1ccc(cc1)OC[C@@H](CN1CCN(CC1)c1c(cccc1)Cl)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 301, 1972.