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Substance Name: 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-((phenyl(phenylmethyl)amino)methyl)-, trihydrochloride
RN: 143760-29-6
InChIKey: YECOUTXOELYMKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H41-F2-N3-O.3Cl-H

Molecular Weight

  • 679.1186
 
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Names and Synonyms

  • 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-((phenyl(phenylmethyl)amino)methyl)-, trihydrochloride

Registry Numbers

CAS Registry Number

  • 143760-29-6

System Generated Number

  • 0143760296

Molecular Formulas

Molecular Formula

  • C36-H41-F2-N3-O.3Cl-H

Molecular Formula Fragments

  • C36-H41-F2-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C36H41F2N3O.3ClH/c37-32-17-13-30(14-18-32)36(31-15-19-33(38)20-16-31)12-7-21-39-22-24-40(25-23-39)27-35(42)28-41(34-10-5-2-6-11-34)26-29-8-3-1-4-9-29;;;/h1-6,8-11,13-20,35-36,42H,7,12,21-28H2;3*1H

InChIKey

YECOUTXOELYMKP-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CN(CC(CN2CCN(CC2)CCCC(c3ccc(cc3)F)c4ccc(cc4)F)O)c5ccccc5.Cl.Cl.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,