3-(2-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-(2-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-(2-methoxyphenyl)-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 1246-0617 |
| Compound Name: | 3-(2-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: | COc1ccccc1\C=C(/C#N)c1nc(cs1)C1=Cc2ccccc2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.9288 |
| logD: | 4.9288 |
| logSw: | -4.8484 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.309 |
| InChI Key: | YUJPDDIDBKUPFZ-UHFFFAOYSA-N |