7-(3,3-dimethyl-2-oxobutoxy)-4-(4-methoxyphenyl)-8-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutoxy)-4-(4-methoxyphenyl)-8-methyl-2H-1-benzopyran-2-one
7-(3,3-dimethyl-2-oxobutoxy)-4-(4-methoxyphenyl)-8-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1514 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutoxy)-4-(4-methoxyphenyl)-8-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C23 H24 O5 |
| Smiles: | Cc1c(ccc2C(=CC(=O)Oc12)c1ccc(cc1)OC)OCC(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6457 |
| logD: | 4.6457 |
| logSw: | -4.6002 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.435 |
| InChI Key: | IGBWGMJDYXINMZ-UHFFFAOYSA-N |