2-[8-(anilinomethyl)-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl]-N-benzylacetamide
Chemical Structure Depiction of
2-[8-(anilinomethyl)-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl]-N-benzylacetamide
2-[8-(anilinomethyl)-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl]-N-benzylacetamide
Compound characteristics
| Compound ID: | E894-1115 |
| Compound Name: | 2-[8-(anilinomethyl)-7-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl]-N-benzylacetamide |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C27 H25 N3 O4 |
| Smiles: | C(C1=Cc2cc3c(cc2N(CC(NCc2ccccc2)=O)C1=O)OCCO3)Nc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5724 |
| logD: | 2.5724 |
| logSw: | -3.0616 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.87 |
| InChI Key: | GISBTVANHFIPGF-UHFFFAOYSA-N |