2-{8-[(4-ethylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{8-[(4-ethylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(4-ethylphenyl)acetamide
2-{8-[(4-ethylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | E894-0573 |
| Compound Name: | 2-{8-[(4-ethylanilino)methyl]-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl}-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C30 H31 N3 O4 |
| Smiles: | CCc1ccc(cc1)NCC1=Cc2cc3c(cc2N(CC(Nc2ccc(CC)cc2)=O)C1=O)OCCO3 |
| Stereo: | ACHIRAL |
| logP: | 5.0477 |
| logD: | 5.0477 |
| logSw: | -4.5528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.548 |
| InChI Key: | KKBJHVPRQCVVCA-UHFFFAOYSA-N |