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Substance Name: Benzenemethanol, 4-(3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)propoxy)-
RN: 119321-50-5
InChIKey: PWPUQWPVRWROSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-F3-N2-O2

Molecular Weight

  • 394.4345
 
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Names and Synonyms

Synonyms

  • 4-(3-(4-(3-(Trifluoromethyl)phenyl)-1-piperazinyl)propoxy)benzenemethanol
  • Benzyl alcohol, p-(3-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)propoxy)-

Systematic Name

  • Benzenemethanol, 4-(3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)propoxy)-

Registry Numbers

CAS Registry Number

  • 119321-50-5

System Generated Number

  • 0119321505

Structure Descriptors

InChI

1S/C21H25F3N2O2/c22-21(23,24)18-3-1-4-19(15-18)26-12-10-25(11-13-26)9-2-14-28-20-7-5-17(16-27)6-8-20/h1,3-8,15,27H,2,9-14,16H2

InChIKey

PWPUQWPVRWROSM-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)N2CCN(CC2)CCCOc3ccc(cc3)CO)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 26, Pg. 642, 1987.