N-{4-[6-(Isopropylamino)-4-Pyrimidinyl]-1,3-Thiazol-2-Yl}-4-Methoxy-N-Methylbenzamide

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Properties Simple | Detailed

Formula C19H21N5O2S
IUPAC Name n-[4-[6-(isopropylamino)-5h-pyrimidine-1,3-diium-5-id-4-yl]-5h-thiazol-3-ium-5-id-2-yl]-4-methoxy-n-methyl-benzamide
Molecular Mass 383.467 g·mol−1
Heat of Formation 4.4 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 454.12 Å 3
Surface Area 364.88 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methoxy-n-methyl-n-[4-[6-(propan-2-ylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]benzamide
  • n-[4-[6-(isopropylamino)-4-pyrimidinyl]-2-thiazolyl]-4-methoxy-n-methylbenzamide
  • n-[4-[6-(isopropylamino)pyrimidin-4-yl]thiazol-2-yl]-4-methoxy-n-methyl-benzamide
InChIKey SQRKGSZJVPRTRN-UHFFFAOYSA-N
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