N-Benzyl-2-(4-Pyrimidinylamino)-1,3-Thiazole-4-Carboxamide

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Properties Simple | Detailed

Formula C15H13N5OS
IUPAC Name n-benzyl-2-(pyrimidin-4-ylamino)thiazole-4-carboxamide
Molecular Mass 311.362 g·mol−1
Heat of Formation 260.0 ± 16.7 kJ·mol−1
Dipole Moment 1.38 ± 1.08 D
Volume 357.09 Å 3
Surface Area 319.23 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -1.35 ± eV
Point Group Symmetry C1
InChIKey DOBKQCZBPPCLEG-UHFFFAOYSA-N
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