N-(2,4-difluorophenyl)-2-{7-[(4-methoxyanilino)methyl]-6-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(6H)-yl}acetamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-2-{7-[(4-methoxyanilino)methyl]-6-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(6H)-yl}acetamide
N-(2,4-difluorophenyl)-2-{7-[(4-methoxyanilino)methyl]-6-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(6H)-yl}acetamide
Compound characteristics
Compound ID: | E894-0859 |
Compound Name: | N-(2,4-difluorophenyl)-2-{7-[(4-methoxyanilino)methyl]-6-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(6H)-yl}acetamide |
Molecular Weight: | 493.47 |
Molecular Formula: | C26 H21 F2 N3 O5 |
Smiles: | COc1ccc(cc1)NCC1=Cc2cc3c(cc2N(CC(Nc2ccc(cc2F)F)=O)C1=O)OCO3 |
Stereo: | ACHIRAL |
logP: | 4.1594 |
logD: | 4.1507 |
logSw: | -4.3105 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.687 |
InChI Key: | WMXNCEUYWYBJRZ-UHFFFAOYSA-N |