2-[(3-Hydroxyphenyl)Amino]-4-[4-Methyl-2-(Methylamino)-1,3-Thiazol-5-Yl]-5-Pyrimidinecarbonitrile

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Properties Simple | Detailed

Formula C16H14N6OS
IUPAC Name 2-(3-hydroxyanilino)-4-[4-methyl-2-(methylamino)thiazol-5-yl]pyrimidine-5-carbonitrile
Molecular Mass 338.387 g·mol−1
Heat of Formation 319.8 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 378.5 Å 3
Surface Area 346.96 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
InChIKey NYRVLHGVDPPWJS-UHFFFAOYSA-N
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