3-benzyl-4,8-dimethyl-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-4,8-dimethyl-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-2-one
3-benzyl-4,8-dimethyl-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y042-8271 |
| Compound Name: | 3-benzyl-4,8-dimethyl-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 376.45 |
| Molecular Formula: | C24 H24 O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OC1CCCCC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9567 |
| logD: | 4.9567 |
| logSw: | -4.8006 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.304 |
| InChI Key: | ICEISICUERNBOJ-QFIPXVFZSA-N |