5-Methyl-6-[(5-Quinolinylamino)Methyl]Pyrido[2,3-D]Pyrimidine-2,4-Diamine

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Properties Simple | Detailed

Formula C18H17N7
IUPAC Name 5-methyl-6-[(5-quinolylamino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
Molecular Mass 331.374 g·mol−1
Heat of Formation 452.7 ± 16.7 kJ·mol−1
Dipole Moment 5.80 ± 1.08 D
Volume 380.4 Å 3
Surface Area 342.63 Å 2
HOMO Energy -8.28 ± 0.55 eV
LUMO Energy -0.87 ± eV
Point Group Symmetry C1
Synonyms
  • (2,4-diamino-5-methyl-pyrido[5,6-e]pyrimidin-6-yl)methyl-(5-quinolyl)amine
  • 2,4-diamino-5-methylpyrido[2,3-d]pyrimidine, 6-[(5-quinolylamino]methyl)-
  • 5-methyl-6-[(5-quinolylamino)methyl]pyrido[3,2-e]pyrimidine-2,4-diamine
  • 5-methyl-6-[(quinolin-5-ylamino)methyl]pyrido[3,2-e]pyrimidine-2,4-diamine
  • 6-([5-quinolylamino]methyl)-2,4-diamino-5-methylpyrido[2,3-d]pyrimidine
  • sri-9439
InChIKey KMSATRJZEXNGDP-UHFFFAOYSA-N
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