(Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide

Formula:C13H10N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide is a drug-like molecule.

MolName(Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide
MolecularFormulaC13H10N2O3S
SmilesO/C(/c1ccccc1)=C\C(C(Nc1nccs1)=O)=O
InChIInChI=1S/C13H10N2O3S/c16-10(9-4-2-1-3-5-9)8-11(17)12(18)15-13-14-6-7-19-13/h1-8,16H,(H,14,15,18)
InChIKUJCZMOJCCCIBEI-UHFFFAOYSA-N
TotalMolweight274.299
Molweight274.299
MonoisotopicMass274.041213
CLogP1.4579
CLogS-2.686
H Acceptors5
H Donors2
TotalSurfaceArea205.74
Relative PSA0.39842
PolarSurfaceArea107.53
Druglikeness0.29965
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! thiazol-2-ylamine
Shape Index0.63158
Fragments1
Non HAtoms19
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Symmetricatoms2
Amides1
Aromatic Nitrogens1
StereoCon

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