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Substance Name: 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-(((3,4-dichlorophenyl)thio)methyl)-
RN: 143759-88-0
InChIKey: TZUGFCWPGYPYIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H32-Cl2-F2-N2-O-S

Molecular Weight

  • 565.5528
 
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Names and Synonyms

Synonym

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

Systematic Name

  • 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-(((3,4-dichlorophenyl)thio)methyl)-

Registry Numbers

CAS Registry Number

  • 143759-88-0

System Generated Number

  • 0143759880

Structure Descriptors

InChI

1S/C29H32Cl2F2N2OS/c30-28-12-11-26(18-29(28)31)37-20-25(36)19-35-16-14-34(15-17-35)13-1-2-27(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22/h3-12,18,25,27,36H,1-2,13-17,19-20H2

InChIKey

TZUGFCWPGYPYIS-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(CCCN2CCN(CC2)CC(CSc3ccc(c(c3)Cl)Cl)O)c4ccc(cc4)F)F

Toxicity

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