2-{8-[(4-methoxyanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-{8-[(4-methoxyanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(3-methylphenyl)acetamide
2-{8-[(4-methoxyanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E894-0838 |
| Compound Name: | 2-{8-[(4-methoxyanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 485.54 |
| Molecular Formula: | C28 H27 N3 O5 |
| Smiles: | Cc1cccc(c1)NC(CN1C(C(CNc2ccc(cc2)OC)=Cc2cc3c(cc12)OCCO3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5287 |
| logD: | 3.5287 |
| logSw: | -3.7069 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.092 |
| InChI Key: | WFJBBGWZYIGMAL-UHFFFAOYSA-N |