propyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
propyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
propyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | 4593-1570 |
| Compound Name: | propyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 430.88 |
| Molecular Formula: | C23 H23 Cl O6 |
| Smiles: | CCCOC(C(C)Oc1ccc2C(C(=COc2c1)Oc1cc(C)c(c(C)c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4457 |
| logD: | 5.4457 |
| logSw: | -5.9121 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.407 |
| InChI Key: | KSBFRANPTVINTI-HNNXBMFYSA-N |