N-Butyl-2-(Methylsulfanyl)Pyrido[2,3-D]Pyrimidin-4-Amine

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Properties Simple | Detailed

Formula C12H16N4S
IUPAC Name n-butyl-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-4-amine
Molecular Mass 248.347 g·mol−1
Heat of Formation 202.4 ± 16.7 kJ·mol−1
Dipole Moment 8.49 ± 1.08 D
Volume 303.51 Å 3
Surface Area 287.02 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-n-butylamino-2-methylthiopyrido(2,3-d)pyrimidine
  • bampp
  • butyl-[2-(methylthio)pyrido[3,2-e]pyrimidin-4-yl]amine
  • n-butyl-2-(methylthio)-4-pyrido[3,2-e]pyrimidinamine
  • n-butyl-2-methylsulfanyl-pyrido[3,2-e]pyrimidin-4-amine
  • n-butyl-2-methylsulfanylpyrido[3,2-e]pyrimidin-4-amine
  • pyrido(2,3-d)pyrimidin-4-amine, n-butyl-2-(methylthio)-
CAS Number(s)
  • 72564-68-2
InChIKey XQEJVKQYWYLGAA-UHFFFAOYSA-N
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