methyl 5-({[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylate
methyl 5-({[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylate
Compound characteristics
| Compound ID: | Y040-9030 |
| Compound Name: | methyl 5-({[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylate |
| Molecular Weight: | 400.38 |
| Molecular Formula: | C21 H20 O8 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1ccc(c2C)OCc1ccc(C(=O)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.384 |
| logD: | 3.384 |
| logSw: | -3.5889 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.753 |
| InChI Key: | OTYYQZZPZOKJTJ-UHFFFAOYSA-N |