4-({4-[4-Methyl-2-(Methylamino)-1,3-Thiazol-5-Yl]-2-Pyrimidinyl}Amino)Phenol

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Properties Simple | Detailed

Formula C15H15N5OS
IUPAC Name 4-[[4-[4-methyl-2-(methylamino)thiazol-5-yl]pyrimidin-2-yl]amino]phenol
Molecular Mass 313.377 g·mol−1
Heat of Formation 198.1 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 355.59 Å 3
Surface Area 330.78 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[4-(4-methyl-2-methylamino-thiazol-5-yl)-pyrimidin-2-ylamino]-phenol
  • 4-[4-(4-methyl-2-methylaminothiazol-5-yl)pyrimidin-2-ylamino]phenol
  • 4-[[4-(4-methyl-2-methylamino-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]phenol
  • 4-[[4-(4-methyl-2-methylamino-5-thiazolyl)-2-pyrimidinyl]amino]phenol
  • 4-[[4-(4-methyl-2-methylamino-thiazol-5-yl)pyrimidin-2-yl]amino]phenol
  • ck6
InChIKey OTMLAWRVLMYMDF-UHFFFAOYSA-N
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