ethyl 2-{[3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Chemical Structure Depiction of
ethyl 2-{[3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
ethyl 2-{[3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Compound characteristics
| Compound ID: | 3793-3467 |
| Compound Name: | ethyl 2-{[3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C21 H19 Cl O5 |
| Smiles: | CCC(C(=O)OCC)Oc1ccc2C(C(=COc2c1)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6072 |
| logD: | 4.6072 |
| logSw: | -4.7037 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.286 |
| InChI Key: | DUCYQCQUHPWKHH-SFHVURJKSA-N |