N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | G837-0014 |
| Compound Name: | N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C18 H16 N4 O5 S2 |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5498 |
| logD: | 3.542 |
| logSw: | -3.9405 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.549 |
| InChI Key: | AWGZARMCOZVZOI-UHFFFAOYSA-N |