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Substance Name: B 1396
RN: 136996-76-4
InChIKey: OYNAEFGMLDYYEZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N3-O3-S.Cl-H

Molecular Weight

  • 385.9136
 
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Names and Synonyms

Results Name

  • B 1396

Synonyms

  • 3-(4-o-Hydroxyphenylpiperazin-1-yl)-1-(4-methylthiazolyl-5-oxy)propan-2-ol hydrochloride
  • B 1396

Systematic Name

  • Phenol, 2-(4-(2-hydroxy-3-((4-methyl-5-thiazolyl)oxy)propyl)-1-piperazinyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 136996-76-4

System Generated Number

  • 0136996764

Molecular Formulas

Molecular Formula

  • C17-H23-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C17-H23-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H23N3O3S.ClH/c1-13-17(24-12-18-13)23-11-14(21)10-19-6-8-20(9-7-19)15-4-2-3-5-16(15)22;/h2-5,12,14,21-22H,6-11H2,1H3;1H

InChIKey

OYNAEFGMLDYYEZ-UHFFFAOYSA-N

Smiles

Cc1c(scn1)OCC(CN2CCN(CC2)c3ccccc3O)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 315mg/kg (315mg/kg)   United States Patent Document. Vol. #5322846,