4-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzene-1-sulfonamide
4-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 0478-0662 |
| Compound Name: | 4-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C14 H11 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1nc2ccc(cc2s1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.913 |
| logD: | 3.529 |
| logSw: | -3.9348 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.031 |
| InChI Key: | MMDQOWJHPOTBNQ-UHFFFAOYSA-N |