2-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
2-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetamide
2-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | 1994-0029 |
| Compound Name: | 2-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetamide |
| Molecular Weight: | 460.23 |
| Molecular Formula: | C20 H11 Cl2 N3 O6 |
| Smiles: | C(C(NN1C(c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O)=O)=O)Oc1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.109 |
| logD: | 3.1073 |
| logSw: | -3.7298 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.708 |
| InChI Key: | CIJWSAIDFWWBJJ-UHFFFAOYSA-N |