4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzene-1-sulfonamide
4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8004-3330 |
| Compound Name: | 4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzene-1-sulfonamide |
| Molecular Weight: | 442.36 |
| Molecular Formula: | C18 H10 N4 O8 S |
| Smiles: | c1cc(ccc1N1C(c2cc(cc3cc(cc(C1=O)c23)[N+]([O-])=O)[N+]([O-])=O)=O)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1161 |
| logD: | 1.115 |
| logSw: | -2.6303 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 145.609 |
| InChI Key: | QKFIRDWLZANQLU-UHFFFAOYSA-N |