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Substance Name: 3,8-Diazabicyclo(3.2.1)octane-8-ethanol, 3-(3-(2-trifluoromethylphenothiazin-10-yl)propyl)-, dihydrochloride
RN: 24054-92-0
InChIKey: VIWGRYXKOCQEGM-UHFFFAOYSA-N

Molecular Formula

  • C24-H28-F3-N3-O-S.2Cl-H

Molecular Weight

  • 536.487
 
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Names and Synonyms

  • 3,8-Diazabicyclo(3.2.1)octane-8-ethanol, 3-(3-(2-trifluoromethylphenothiazin-10-yl)propyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 24054-92-0

System Generated Number

  • 0024054920

Molecular Formulas

Molecular Formula

  • C24-H28-F3-N3-O-S.2Cl-H

Molecular Formula Fragments

  • C24-H28-F3-N3-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H28F3N3OS.2ClH/c25-24(26,27)17-6-9-23-21(14-17)30(20-4-1-2-5-22(20)32-23)11-3-10-28-15-18-7-8-19(16-28)29(18)12-13-31;;/h1-2,4-6,9,14,18-19,31H,3,7-8,10-13,15-16H2;2*1H

InChIKey

VIWGRYXKOCQEGM-UHFFFAOYSA-N

Smiles

C1[C@@H]2CC[C@@H](CN1CCCN1c3ccccc3Sc3ccc(cc13)C(F)(F)F)N2CCO.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 836, 1969.