N-(2,6-dimethoxypyrimidin-4-yl)-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2,6-dimethoxypyrimidin-4-yl)-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzene-1-sulfonamide
N-(2,6-dimethoxypyrimidin-4-yl)-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 1616-0083 |
| Compound Name: | N-(2,6-dimethoxypyrimidin-4-yl)-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzene-1-sulfonamide |
| Molecular Weight: | 473.42 |
| Molecular Formula: | C18 H15 N7 O7 S |
| Smiles: | COc1cc(NS(c2ccc(cc2)Nc2ccc3c(c2[N+]([O-])=O)non3)(=O)=O)nc(n1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.145 |
| logD: | 1.0174 |
| logSw: | -4.5566 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 151.899 |
| InChI Key: | RRYCQMQHEMQSHP-UHFFFAOYSA-N |