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Substance Name: 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-((((4-chlorophenyl)methyl)thio)methyl)-
RN: 143760-16-1
InChIKey: VJPMOOUZBXJLTM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H35-Cl-F2-N2-O-S

Molecular Weight

  • 545.1345
 
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Names and Synonyms

Synonym

  • 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(3-(4-chlorophenylmethylthio)-2-hydroxypropyl)piperazine

Systematic Name

  • 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-((((4-chlorophenyl)methyl)thio)methyl)-

Registry Numbers

CAS Registry Number

  • 143760-16-1

System Generated Number

  • 0143760161

Structure Descriptors

InChI

1S/C30H35ClF2N2OS/c31-26-9-3-23(4-10-26)21-37-22-29(36)20-35-18-16-34(17-19-35)15-1-2-30(24-5-11-27(32)12-6-24)25-7-13-28(33)14-8-25/h3-14,29-30,36H,1-2,15-22H2

InChIKey

VJPMOOUZBXJLTM-UHFFFAOYSA-N

Smiles

c1cc(ccc1CSCC(CN2CCN(CC2)CCCC(c3ccc(cc3)F)c4ccc(cc4)F)O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5391552,