| MolName | (Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide |
| MolecularFormula | C13H10N2O3S |
| Smiles | O/C(/c1ccccc1)=C\C(C(Nc1nccs1)=O)=O |
| InChI | InChI=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) |
| InChIK | UJCZMOJCCCIBEI-UHFFFAOYSA-N |
| TotalMolweight | 274.299 |
| Molweight | 274.299 |
| MonoisotopicMass | 274.041213 |
| CLogP | 1.4579 |
| CLogS | -2.686 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 205.74 |
| Relative PSA | 0.39842 |
| PolarSurfaceArea | 107.53 |
| Druglikeness | 0.29965 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! thiazol-2-ylamine |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide | 2 - (Z)-4-hydroxy-2-oxo-4-phenyl-N-(1,3-thiazol-2-yl)but-3-enamide