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Substance Name: 5H-Thiazolo(3,2-a)pyrimidin-3-ol, 2,3,6,7-tetrahydro-3-(4-methylphenyl)-2-(2-phenylethyl)-, monohydrobromide
RN: 86347-00-4
InChIKey: VCXPPTPKFYYHBW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N2-O2-S.Br-H

Molecular Weight

  • 433.4115
 
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Names and Synonyms

  • 5H-Thiazolo(3,2-a)pyrimidin-3-ol, 2,3,6,7-tetrahydro-3-(4-methylphenyl)-2-(2-phenylethyl)-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 86347-00-4

System Generated Number

  • 0086347004

Molecular Formulas

Molecular Formula

  • C21-H24-N2-O2-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C21-H24-N2-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H24N2OS.BrH/c1-16-8-11-18(12-9-16)21(24)19(13-10-17-6-3-2-4-7-17)25-20-22-14-5-15-23(20)21;/h2-4,6-9,11-12,19,24H,5,10,13-15H2,1H3;1H

InChIKey

VCXPPTPKFYYHBW-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)C2(C(SC3=NCCCN32)CCc4ccccc4)O.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4431648,