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Substance Name: 3(2H)-Isoquinolinone, 1,4-dihydro-1-(4-aminophenyl)-4,4,7-trimethyl-
RN: 40119-35-5
InChIKey: HZGATBMNGJMFPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-N2-O

Molecular Weight

  • 280.369
 
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Names and Synonyms

Synonyms

  • 1,4-Dihydro-1-(4-aminophenyl)-4,4,7-trimethyl-3(2H)-isoquinolinone
  • 5-22-13-00150 (Beilstein Handbook Reference)
  • BRN 0488986

Systematic Name

  • 3(2H)-Isoquinolinone, 1,4-dihydro-1-(4-aminophenyl)-4,4,7-trimethyl-

Registry Numbers

CAS Registry Number

  • 40119-35-5

System Generated Number

  • 0040119355

Structure Descriptors

InChI

1S/C18H20N2O/c1-11-4-9-15-14(10-11)16(20-17(21)18(15,2)3)12-5-7-13(19)8-6-12/h4-10,16H,19H2,1-3H3,(H,20,21)

InChIKey

HZGATBMNGJMFPB-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)C(NC(=O)C2(C)C)c3ccc(cc3)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1600mg/kg (1600mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1384, 1977.