3-(4-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-(4-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-(4-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 0237-0069 |
| Compound Name: | 3-(4-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile |
| Molecular Weight: | 386.43 |
| Molecular Formula: | C22 H14 N2 O3 S |
| Smiles: | COc1ccc(/C=C(/C#N)c2nc(cs2)C2=Cc3ccccc3OC2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.856 |
| logD: | 4.856 |
| logSw: | -4.8168 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.222 |
| InChI Key: | JTORYCJGTIZNQS-UHFFFAOYSA-N |