8-(4-ethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Chemical Structure Depiction of
8-(4-ethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
8-(4-ethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Compound characteristics
| Compound ID: | C567-0258 |
| Compound Name: | 8-(4-ethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one |
| Molecular Weight: | 459.47 |
| Molecular Formula: | C27 H22 F N O5 |
| Smiles: | CCOc1ccc(cc1)C(C1=CN(Cc2ccccc2F)c2cc3c(cc2C1=O)OCCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0843 |
| logD: | 4.0843 |
| logSw: | -4.2185 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.976 |
| InChI Key: | XCDAWTMSZYAKTB-UHFFFAOYSA-N |