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Substance Name: 1-Thia-4,8-diazaspiro(4.5)decan-3-one, 8-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-4-(4-methylphenyl)-, monohydrochloride
RN: 24854-55-5
InChIKey: QRUPOGSJBJLBSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-N2-O3-S.Cl-H

Molecular Weight

  • 446.996
 
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Names and Synonyms

Synonym

  • 8-(1,4-Benzodioxan-2-ylmethyl)-3-oxo-4-p-tolyl-1-thia-4,8-diazaspiro(4.5)decane hydrochloride

Systematic Name

  • 1-Thia-4,8-diazaspiro(4.5)decan-3-one, 8-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-4-(4-methylphenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 24854-55-5

System Generated Number

  • 0024854555

Molecular Formulas

Molecular Formula

  • C23-H26-N2-O3-S.Cl-H

Molecular Formula Fragments

  • C23-H26-N2-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H26N2O3S.ClH/c1-17-6-8-18(9-7-17)25-22(26)16-29-23(25)10-12-24(13-11-23)14-19-15-27-20-4-2-3-5-21(20)28-19;/h2-9,19H,10-16H2,1H3;1H

InChIKey

QRUPOGSJBJLBSM-UHFFFAOYSA-N

Smiles

S1CC(N(C21CCN(CC2)C[C@@H]1Oc2c(OC1)cccc2)c1ccc(cc1)C)=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 400mg/kg (400mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Yakugaku Zasshi. Journal of Pharmacy. Vol. 91, Pg. 798, 1971.