3-benzyl-4-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-4-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
3-benzyl-4-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1311-2232 |
| Compound Name: | 3-benzyl-4-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C26 H22 O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OCC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2663 |
| logD: | 5.2663 |
| logSw: | -5.3581 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.363 |
| InChI Key: | GQFVWVITMRHWLL-UHFFFAOYSA-N |