N~6~-(3,5-Dimethoxybenzyl)-N~6~-Methylpyrido[2,3-D]Pyrimidine-2,4,6-Triamine

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Formula C17H20N6O2
IUPAC Name n6-[(3,5-dimethoxyphenyl)methyl]-n6-methyl-pyrido[2,3-d]pyrimidine-2,4,6-triamine
Molecular Mass 340.380 g·mol−1
Heat of Formation 27.6 ± 16.7 kJ·mol−1
Dipole Moment 8.99 ± 1.08 D
Volume 405.14 Å 3
Surface Area 340.05 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • (2,4-diaminopyrido[6,5-d]pyrimidin-6-yl)-(3,5-dimethoxybenzyl)-methyl-amine
  • 2,4-diamino-6-[n-(3',5'-dimethoxybenzyl)-n-methylamino]pyrido[2,3-d]pyrimidine
  • coq
  • n6-[(3,5-dimethoxyphenyl)methyl]-n6-methyl-pyrido[5,6-e]pyrimidine-2,4,6-triamine
  • n6-[(3,5-dimethoxyphenyl)methyl]-n6-methylpyrido[5,6-e]pyrimidine-2,4,6-triamine
InChIKey XWCCXDBXMCTZPW-UHFFFAOYSA-N
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