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Substance Name: 1-Piperazineethanol, 4-(2-(2-methylpropoxy)phenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-,monohydrochloride
RN: 136996-79-7
InChIKey: JDABMSLLUFHJEA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H31-N3-O3-S.Cl-H

Molecular Weight

  • 442.0208
 
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Names and Synonyms

Synonyms

  • 3-(4-o-Isobutoxyphenylpiperazin-1-yl)-1-(4-methylthiazolyl-5-oxy)propan-2-ol hydrochloride
  • B 1431

Systematic Name

  • 1-Piperazineethanol, 4-(2-(2-methylpropoxy)phenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-,monohydrochloride

Registry Numbers

CAS Registry Number

  • 136996-79-7

System Generated Number

  • 0136996797

Molecular Formulas

Molecular Formula

  • C21-H31-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C21-H31-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H31N3O3S.ClH/c1-16(2)13-26-20-7-5-4-6-19(20)24-10-8-23(9-11-24)12-18(25)14-27-21-17(3)22-15-28-21;/h4-7,15-16,18,25H,8-14H2,1-3H3;1H

InChIKey

JDABMSLLUFHJEA-UHFFFAOYSA-N

Toxicity

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