N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-3-nitrobenzene-1-sulfonamide
N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8013-0707 |
| Compound Name: | N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 462.5 |
| Molecular Formula: | C20 H18 N2 O7 S2 |
| Smiles: | Cc1c(cc(c(c1C)O)S(c1ccccc1)(=O)=O)NS(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3833 |
| logD: | 2.142 |
| logSw: | -3.7799 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.552 |
| InChI Key: | MFCAAIAHBUUNIP-UHFFFAOYSA-N |