methyl 2-{[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}propanoate
Chemical Structure Depiction of
methyl 2-{[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}propanoate
methyl 2-{[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}propanoate
Compound characteristics
| Compound ID: | G856-6245 |
| Compound Name: | methyl 2-{[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}propanoate |
| Molecular Weight: | 398.41 |
| Molecular Formula: | C22 H22 O7 |
| Smiles: | CC(C(=O)OC)Oc1ccc2c(c1)C(C)=C(C(=O)O2)c1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3539 |
| logD: | 3.3539 |
| logSw: | -3.4882 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.112 |
| InChI Key: | SYIRRFGACTWCAJ-ZDUSSCGKSA-N |