4-acetyl-N-(2-methoxy-4-nitrophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-(2-methoxy-4-nitrophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-(2-methoxy-4-nitrophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | F053-0527 |
| Compound Name: | 4-acetyl-N-(2-methoxy-4-nitrophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C17 H17 N3 O6 S2 |
| Smiles: | CC(N1CCSc2ccc(cc12)S(Nc1ccc(cc1OC)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4931 |
| logD: | -0.6488 |
| logSw: | -3.0091 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.254 |
| InChI Key: | CTWKEGMCESCNAR-UHFFFAOYSA-N |