1-(3-{[4-(2-Pyridinyl)-1-Piperazinyl]Sulfonyl}Phenyl)-3-(1,3-Thiazol-2-Yl)Urea

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Properties Simple | Detailed

Formula C19H20N6O3S2
IUPAC Name 1-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenyl]-3-thiazol-2-yl-urea
Molecular Mass 444.531 g·mol−1
Heat of Formation -49.3 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 486.17 Å 3
Surface Area 426.09 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]-3-(1,3-thiazol-2-yl)urea
  • 1-[3-[[4-(2-pyridyl)-1-piperazinyl]sulfonyl]phenyl]-3-(2-thiazolyl)urea
  • gax
InChIKey NJPVZSIGDRLLTD-UHFFFAOYSA-N
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