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Substance Name: 1-Piperazineethanol, 4-(2-(1-methylethoxy)phenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-,monohydrochloride
RN: 136996-78-6
InChIKey: PQFIQIOUNCXCEF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N3-O3-S.Cl-H

Molecular Weight

  • 427.994
 
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Names and Synonyms

Synonyms

  • 3-(4-o-Isopropoxyphenylpiperazin-1-yl)-1-(4-methylthiazolyl-5-oxy)propan-2-ol hydrochloride
  • B 1429

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 136996-78-6

System Generated Number

  • 0136996786

Molecular Formulas

Molecular Formula

  • C20-H29-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C20-H29-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H29N3O3S.ClH/c1-15(2)26-19-7-5-4-6-18(19)23-10-8-22(9-11-23)12-17(24)13-25-20-16(3)21-14-27-20;/h4-7,14-15,17,24H,8-13H2,1-3H3;1H

InChIKey

PQFIQIOUNCXCEF-UHFFFAOYSA-N

Smiles

Cc1c(scn1)OCC(CN2CCN(CC2)c3ccccc3OC(C)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 428mg/kg (428mg/kg)   United States Patent Document. Vol. #5322846,