8-(3,4-dimethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Chemical Structure Depiction of
8-(3,4-dimethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
8-(3,4-dimethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Compound characteristics
Compound ID: | C567-0278 |
Compound Name: | 8-(3,4-dimethoxybenzoyl)-6-[(2-fluorophenyl)methyl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one |
Molecular Weight: | 475.47 |
Molecular Formula: | C27 H22 F N O6 |
Smiles: | COc1ccc(cc1OC)C(C1=CN(Cc2ccccc2F)c2cc3c(cc2C1=O)OCCO3)=O |
Stereo: | ACHIRAL |
logP: | 3.392 |
logD: | 3.392 |
logSw: | -3.8725 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.113 |
InChI Key: | UYTBRNVPQTZZKZ-UHFFFAOYSA-N |