5-Amino-N-Tert-Butyl-4-(3-Methoxyphenyl)-2-(Methylsulfanyl)Thieno[2,3-D]Pyrimidine-6-Carboxamide

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Formula C19H22N4O2S2
IUPAC Name 5-amino-n-tert-butyl-4-(3-methoxyphenyl)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxamide
Molecular Mass 402.534 g·mol−1
Heat of Formation -133.7 ± 16.7 kJ·mol−1
Dipole Moment 4.93 ± 1.08 D
Volume 461.01 Å 3
Surface Area 405.99 Å 2
HOMO Energy -8.07 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
Synonyms
  • 5-amino-n-tert-butyl-4-(3-methoxyphenyl)-2-(methylthio)-6-thieno[5,4-d]pyrimidinecarboxamide
  • 5-amino-n-tert-butyl-4-(3-methoxyphenyl)-2-(methylthio)thieno[5,4-d]pyrimidine-6-carboxamide
  • 5-amino-n-tert-butyl-4-(3-methoxyphenyl)-2-methylsulfanyl-thieno[5,4-d]pyrimidine-6-carboxamide
  • 5-amino-n-tert-butyl-4-(3-methoxyphenyl)-2-methylsulfanylthieno[5,4-d]pyrimidine-6-carboxamide
InChIKey DVSFSADBOJYPGF-UHFFFAOYSA-N
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