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Substance Name: 3(2H)-Isoquinolinone, 1,4-dihydro-1-(2-aminophenyl)-4,4-dimethyl-
RN: 64097-19-4
InChIKey: WLCXARDBSLUIBR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N2-O

Molecular Weight

  • 266.3422
 
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Names and Synonyms

Synonyms

  • 1,4-Dihydro-1-(2-aminophenyl)-4,4-dimethyl-3(2H)-isoquinolinone
  • 5-22-13-00145 (Beilstein Handbook Reference)
  • BRN 0416269

Systematic Name

  • 3(2H)-Isoquinolinone, 1,4-dihydro-1-(2-aminophenyl)-4,4-dimethyl-

Registry Numbers

CAS Registry Number

  • 64097-19-4

System Generated Number

  • 0064097194

Structure Descriptors

InChI

1S/C17H18N2O/c1-17(2)13-9-5-3-7-11(13)15(19-16(17)20)12-8-4-6-10-14(12)18/h3-10,15H,18H2,1-2H3,(H,19,20)

InChIKey

WLCXARDBSLUIBR-UHFFFAOYSA-N

Smiles

CC1(c2ccccc2C(NC1=O)c3ccccc3N)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1384, 1977.