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Substance Name: 1-Piperazineethanol, alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-4-(3-(trifluoromethyl)phenyl)-,monohydrochloride
RN: 136996-80-0
InChIKey: FZYZDGGZRTZZRR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-F3-N3-O2-S.Cl-H

Molecular Weight

  • 437.9117
 
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Names and Synonyms

Synonyms

  • 3-(4-m-Trifluoromethylphenylpiperazin-1-yl)-1-(4-methylthiazolyl-5-oxy)propan-2-ol HCl
  • B 1489

Systematic Name

  • 1-Piperazineethanol, alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-4-(3-(trifluoromethyl)phenyl)-,monohydrochloride

Registry Numbers

CAS Registry Number

  • 136996-80-0

System Generated Number

  • 0136996800

Molecular Formulas

Molecular Formula

  • C18-H22-F3-N3-O2-S.Cl-H

Molecular Formula Fragments

  • C18-H22-F3-N3-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H22F3N3O2S.ClH/c1-13-17(27-12-22-13)26-11-16(25)10-23-5-7-24(8-6-23)15-4-2-3-14(9-15)18(19,20)21;/h2-4,9,12,16,25H,5-8,10-11H2,1H3;1H

InChIKey

FZYZDGGZRTZZRR-UHFFFAOYSA-N

Smiles

Cc1c(scn1)OCC(CN2CCN(CC2)c3cccc(c3)C(F)(F)F)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5322846,