methyl 2-{[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
methyl 2-{[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
methyl 2-{[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | Y040-7958 |
| Compound Name: | methyl 2-{[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 368.77 |
| Molecular Formula: | C17 H17 Cl O7 |
| Smiles: | CC(C(=O)OC)Oc1cc2c(cc1[Cl])C(C)=C(CC(=O)OC)C(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1313 |
| logD: | 3.1313 |
| logSw: | -3.2881 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.788 |
| InChI Key: | HDZIGRGCVIDDLJ-VIFPVBQESA-N |