3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
Chemical Structure Depiction of
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | Y041-1192 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate |
| Molecular Weight: | 406.43 |
| Molecular Formula: | C24 H22 O6 |
| Smiles: | C1CCC(CC1)C(=O)Oc1ccc2C(C(=COc2c1)c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6481 |
| logD: | 3.6481 |
| logSw: | -3.9176 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.253 |
| InChI Key: | JRWLYLSFDBVWPS-UHFFFAOYSA-N |