N-[2-(1,3-benzothiazol-2-yl)-4-nitrophenyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(1,3-benzothiazol-2-yl)-4-nitrophenyl]-4-methylbenzene-1-sulfonamide
N-[2-(1,3-benzothiazol-2-yl)-4-nitrophenyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 0333-0296 |
| Compound Name: | N-[2-(1,3-benzothiazol-2-yl)-4-nitrophenyl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 425.48 |
| Molecular Formula: | C20 H15 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1c1nc2ccccc2s1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2918 |
| logD: | 3.7923 |
| logSw: | -5.4328 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.021 |
| InChI Key: | ZVZDRDPLOLZJJH-UHFFFAOYSA-N |