4-(2-chlorophenyl)-7-hydroxy-2-oxo-2H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
4-(2-chlorophenyl)-7-hydroxy-2-oxo-2H-1-benzopyran-3-carbonitrile
4-(2-chlorophenyl)-7-hydroxy-2-oxo-2H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-7868 |
| Compound Name: | 4-(2-chlorophenyl)-7-hydroxy-2-oxo-2H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 297.7 |
| Molecular Formula: | C16 H8 Cl N O3 |
| Smiles: | C(C1=C(c2ccc(cc2OC1=O)O)c1ccccc1[Cl])#N |
| Stereo: | ACHIRAL |
| logP: | 3.1647 |
| logD: | 3.0195 |
| logSw: | -3.4916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.562 |
| InChI Key: | FXDKUBHXDHFWOP-UHFFFAOYSA-N |