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Substance Name: 1-Piperazineethanol, 4-(4-chloro-2-methylphenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-, monohydrochloride
RN: 136996-77-5
InChIKey: VHRPLZUEYULKAY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-Cl-N3-O2-S.Cl-H

Molecular Weight

  • 418.3865
 
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Names and Synonyms

Synonyms

  • 3-(4-(4-Chloro-2-methylphenyl)piperazin-1-yl)-1-(4-methylthiazolyl-5-oxy)propan-2-ol HCl
  • B 1406

Systematic Name

  • 1-Piperazineethanol, 4-(4-chloro-2-methylphenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 136996-77-5

System Generated Number

  • 0136996775

Molecular Formulas

Molecular Formula

  • C18-H24-Cl-N3-O2-S.Cl-H

Molecular Formula Fragments

  • C18-H24-Cl-N3-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H24ClN3O2S.ClH/c1-13-9-15(19)3-4-17(13)22-7-5-21(6-8-22)10-16(23)11-24-18-14(2)20-12-25-18;/h3-4,9,12,16,23H,5-8,10-11H2,1-2H3;1H

InChIKey

VHRPLZUEYULKAY-UHFFFAOYSA-N

Smiles

Cc1cc(ccc1N2CCN(CC2)CC(COc3c(ncs3)C)O)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 515mg/kg (515mg/kg)   United States Patent Document. Vol. #5322846,