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Substance Name: 1(2H)-Isoquinolinone, 6-amino-7-chloro-2-((5-methyl-1H-imidazol-4-yl)methyl)-, dihydrochloride
RN: 142678-44-2
InChIKey: NNFXLHWIMBPGFN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H13-Cl-N4-O.2Cl-H

Molecular Weight

  • 361.6585
 
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Names and Synonyms

Synonym

  • 6-Amino-7-chloro-1,2-dihydro-2-((5(4)-methyl-4(5)-imidazolyl)methyl)-1-oxoisoquinoline 2HCl

Systematic Name

  • 1(2H)-Isoquinolinone, 6-amino-7-chloro-2-((5-methyl-1H-imidazol-4-yl)methyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 142678-44-2

System Generated Number

  • 0142678442

Molecular Formulas

Molecular Formula

  • C14-H13-Cl-N4-O.2Cl-H

Molecular Formula Fragments

  • C14-H13-Cl-N4-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H13ClN4O.2ClH/c1-8-13(18-7-17-8)6-19-3-2-9-4-12(16)11(15)5-10(9)14(19)20;;/h2-5,7H,6,16H2,1H3,(H,17,18);2*1H

InChIKey

NNFXLHWIMBPGFN-UHFFFAOYSA-N

Smiles

Cc1c(nc[nH]1)Cn2ccc3cc(c(cc3c2=O)Cl)N.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 50mg/kg (50mg/kg)   Journal of Medicinal Chemistry. Vol. 35, Pg. 3307, 1992.