N-(3-acetylphenyl)-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-(3-acetylphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide
N-(3-acetylphenyl)-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: | E894-1240 |
| Compound Name: | N-(3-acetylphenyl)-2-{8-[(4-methylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}acetamide |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | CC(c1cccc(c1)NC(CN1C(C(CNc2ccc(C)cc2)=Cc2cc3c(cc12)OCCO3)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3507 |
| logD: | 3.3506 |
| logSw: | -3.5615 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.375 |
| InChI Key: | NGFBCIVHIXBWRC-UHFFFAOYSA-N |