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Substance Name: 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3,6-dimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (R)-
RN: 108445-53-0
InChIKey: ZCOSRBHWIPTZHW-OCJWVHHSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H29-N3-O3.Cl-H

Molecular Weight

  • 455.983
 
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Names and Synonyms

  • 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3,6-dimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (R)-

Registry Numbers

CAS Registry Number

  • 108445-53-0

System Generated Number

  • 0108445530

Molecular Formulas

Molecular Formula

  • C25-H29-N3-O3.Cl-H

Molecular Formula Fragments

  • C25-H29-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H29N3O3.ClH/c1-14-8-15(2)24(16(3)9-14)26-23-13-20-19-12-22(31-7)21(30-6)11-18(19)10-17(4)28(20)25(29)27(23)5;/h8-9,11-13,17H,10H2,1-7H3;1H/b26-23+;/t17-;/m1./s1

InChIKey

ZCOSRBHWIPTZHW-OCJWVHHSSA-N

Smiles

Cc1cc(c(c(c1)C)/N=c/2\cc-3n(c(=O)n2C)[C@@H](Cc4c3cc(c(c4)OC)OC)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 312mg/kg (312mg/kg)   Helvetica Chimica Acta. Vol. 69, Pg. 1671, 1986.