(5Z)-5-(6-Quinolinylmethylene)-2-[(2-Thienylmethyl)Amino]-1,3-Thiazol-4(5H)-One

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Properties Simple | Detailed

Formula C18H13N3OS2
IUPAC Name (5z)-5-(6-quinolylmethylene)-2-(2-thienylmethylamino)thiazol-4-one
Molecular Mass 351.445 g·mol−1
Heat of Formation 355.9 ± 16.7 kJ·mol−1
Dipole Moment 6.25 ± 1.08 D
Volume 394.08 Å 3
Surface Area 358.99 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 1.95 ± eV
Point Group Symmetry C1
Synonyms
  • (5z)-5-(6-quinolylmethylene)-2-(2-thienylmethylamino)-4-thiazolone
  • (5z)-5-(6-quinolylmethylene)-2-(2-thienylmethylamino)thiazol-4-one
  • cdk1 inhibitor iv, ro-3306
InChIKey XOLMRFUGOINFDQ-YBEGLDIGSA-N
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