Chem
J-GLOBAL ID：200907013878700362   Nikkaji number：J746.179H

PD-158780

PD-158780
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C14H12BrN5
Molecular formula furigana： C14-H12-BR-N5
Molecular weight： 330.189
InChI： InChI=1S/C14H12BrN5/c1-16-13-6-11-12(7-17-13)18-8-19-14(11)20-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,16,17)(H,18,19,20)
InChI key： KFHMLBXBRCITHF-UHFFFAOYSA-N
SMILES： CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
Systematic name  (3)：
  • N-(3-ブロモフェニル)-N′-メチルピリド[3,4-d]ピリミジン-4,6-ジアミン
  • N4-(3-ブロモフェニル)-N6-メチルピリド[3,4-d]ピリミジン-4,6-ジアミン
  • N4-(3-bromophenyl)-N6-methylpyrido[3,4-d]pyrimidine-4,6-diamine
Other name (2)：
  • N-(3-Bromophenyl)-N′-methylpyrido[3,4-d]pyrimidine-4,6-diamine
  • PD-158780
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