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Substance Name: 9H-(1,3)Dioxolo(4,5-h)pyrimido(1,6-d)(1,4)benzoxazepin-4-one, 2,3,6,7-tetrahydro-3,6-dimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (+-)-
RN: 108446-05-5
InChIKey: HJAVDYDRZHCCIC-OSMRDGEFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H25-N3-O4.Cl-H

Molecular Weight

  • 455.9394
 
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Names and Synonyms

  • 9H-(1,3)Dioxolo(4,5-h)pyrimido(1,6-d)(1,4)benzoxazepin-4-one, 2,3,6,7-tetrahydro-3,6-dimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 108446-05-5

System Generated Number

  • 0108446055

Molecular Formulas

Molecular Formula

  • C24-H25-N3-O4.Cl-H

Molecular Formula Fragments

  • C24-H25-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H25N3O4.ClH/c1-13-6-14(2)23(15(3)7-13)25-22-9-18-17-8-20-21(31-12-30-20)10-19(17)29-11-16(4)27(18)24(28)26(22)5;/h6-10,16H,11-12H2,1-5H3;1H/b25-22+;

InChIKey

HJAVDYDRZHCCIC-OSMRDGEFSA-N

Smiles

Cc1cc(c(c(c1)C)/N=c/2\cc-3n(c(=O)n2C)C(COc4c3cc5c(c4)OCO5)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 4gm/kg (4000mg/kg)   Helvetica Chimica Acta. Vol. 69, Pg. 1671, 1986.