N-(4-ethoxyphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide
N-(4-ethoxyphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide
Compound characteristics
Compound ID: | E894-0479 |
Compound Name: | N-(4-ethoxyphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide |
Molecular Weight: | 499.57 |
Molecular Formula: | C29 H29 N3 O5 |
Smiles: | CCOc1ccc(cc1)NC(CN1C(C(CNc2ccc(C)cc2)=Cc2cc3c(cc12)OCCO3)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9787 |
logD: | 3.9787 |
logSw: | -3.9443 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.672 |
InChI Key: | HEXZAUIWCDLCQS-UHFFFAOYSA-N |