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Substance Name: 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3,7-dimethyl-2-(phenylimino)-, monohydrochloride, (+-)-
RN: 108445-72-3
InChIKey: XZKLUUHMNSHMOA-FKWCIMQXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H23-N3-O3.Cl-H

Molecular Weight

  • 413.9026
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 108445-72-3

System Generated Number

  • 0108445723

Molecular Formulas

Molecular Formula

  • C22-H23-N3-O3.Cl-H

Molecular Formula Fragments

  • C22-H23-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H23N3O3.ClH/c1-14-13-25-18(17-11-20(28-4)19(27-3)10-16(14)17)12-21(24(2)22(25)26)23-15-8-6-5-7-9-15;/h5-12,14H,13H2,1-4H3;1H/b23-21+;

InChIKey

XZKLUUHMNSHMOA-FKWCIMQXSA-N

Smiles

CC1Cn2c(c/c(=N\c3ccccc3)/n(c2=O)C)-c4c1cc(c(c4)OC)OC.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.