ethyl 3-{4,8-dimethyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{4,8-dimethyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{4,8-dimethyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y040-0609 |
| Compound Name: | ethyl 3-{4,8-dimethyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 386.44 |
| Molecular Formula: | C22 H26 O6 |
| Smiles: | CCOC(CCC1=C(C)c2ccc(c(C)c2OC1=O)OC1CCCCC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9086 |
| logD: | 3.9086 |
| logSw: | -3.9933 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.734 |
| InChI Key: | CPTLPVIBFBVMNO-IBGZPJMESA-N |