3-[4-(diethylamino)phenyl]-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-[4-(diethylamino)phenyl]-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-[4-(diethylamino)phenyl]-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 4296-0232 |
| Compound Name: | 3-[4-(diethylamino)phenyl]-2-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C25 H21 N3 O2 S |
| Smiles: | CCN(CC)c1ccc(/C=C(/C#N)c2nc(cs2)C2=Cc3ccccc3OC2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6841 |
| logD: | 5.6824 |
| logSw: | -5.6378 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.415 |
| InChI Key: | FSHZAQGFLSNUJF-UHFFFAOYSA-N |