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Substance Name: Thiazolidine, 3-(4-cyclohexylpentyl)-, hydrochloride, hemihydrate
RN: 69226-55-7
InChIKey: ICNISIXRTWCOGC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H27-N-S.Cl-H.1/2H2-O

Molecular Weight

  • 573.8172
 
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Names and Synonyms

Synonym

  • 3-(4-Cyclohexylpentyl)thiazolidine hydrochloride hemihydrate

Systematic Name

  • Thiazolidine, 3-(4-cyclohexylpentyl)-, hydrochloride, hemihydrate

Registry Numbers

CAS Registry Number

  • 69226-55-7

System Generated Number

  • 0069226557

Molecular Formulas

Molecular Formula

  • C14-H27-N-S.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C14-H27-N-S
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/2C14H27NS.2ClH.H2O/c2*1-13(14-7-3-2-4-8-14)6-5-9-15-10-11-16-12-15;;;/h2*13-14H,2-12H2,1H3;2*1H;1H2

InChIKey

ICNISIXRTWCOGC-UHFFFAOYSA-N

Smiles

CC(CCCN1CCSC1)C2CCCCC2.CC(CCCN1CCSC1)C2CCCCC2.O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 180mg/kg (180mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 968, 1972.