3-(4-chlorophenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-(4-chlorophenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-(4-chlorophenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 1711-1471 |
| Compound Name: | 3-(4-chlorophenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile |
| Molecular Weight: | 390.85 |
| Molecular Formula: | C21 H11 Cl N2 O2 S |
| Smiles: | C(=C(/C#N)c1nc(cs1)C1=Cc2ccccc2OC1=O)/c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4684 |
| logD: | 5.4684 |
| logSw: | -6.3276 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.679 |
| InChI Key: | JGSVYPQYYKAXJW-UHFFFAOYSA-N |