8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methoxybenzoate
Chemical Structure Depiction of
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methoxybenzoate
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y040-0575 |
| Compound Name: | 8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methoxybenzoate |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.573 |
| logD: | 4.573 |
| logSw: | -4.5556 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.338 |
| InChI Key: | XETATJYYAGJXEO-UHFFFAOYSA-N |