cyclopentylidene[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]acetonitrile
Chemical Structure Depiction of
cyclopentylidene[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]acetonitrile
cyclopentylidene[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]acetonitrile
Compound characteristics
| Compound ID: | 4088-0216 |
| Compound Name: | cyclopentylidene[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]acetonitrile |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C19 H14 N2 O2 S |
| Smiles: | C1CCC(C1)=C(C#N)c1nc(cs1)C1=Cc2ccccc2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.1007 |
| logD: | 4.1007 |
| logSw: | -4.5341 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.237 |
| InChI Key: | QYROMSWMJQHODQ-UHFFFAOYSA-N |