methyl 2-{[4-(4-methoxyphenyl)-7-methyl-2-oxo-2H-1-benzopyran-5-yl]oxy}propanoate
Chemical Structure Depiction of
methyl 2-{[4-(4-methoxyphenyl)-7-methyl-2-oxo-2H-1-benzopyran-5-yl]oxy}propanoate
methyl 2-{[4-(4-methoxyphenyl)-7-methyl-2-oxo-2H-1-benzopyran-5-yl]oxy}propanoate
Compound characteristics
| Compound ID: | Y040-1300 |
| Compound Name: | methyl 2-{[4-(4-methoxyphenyl)-7-methyl-2-oxo-2H-1-benzopyran-5-yl]oxy}propanoate |
| Molecular Weight: | 368.38 |
| Molecular Formula: | C21 H20 O6 |
| Smiles: | CC(C(=O)OC)Oc1cc(C)cc2c1C(=CC(=O)O2)c1ccc(cc1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8647 |
| logD: | 3.8647 |
| logSw: | -4.3673 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.967 |
| InChI Key: | XRMXVTURWFDZCI-ZDUSSCGKSA-N |