N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | G786-0853 |
| Compound Name: | N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C20 H21 N3 O3 S2 |
| Smiles: | Cc1ccc(C)c2c1nc(NC(c1ccc(cc1)S(N1CCCC1)(=O)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.661 |
| logD: | 4.6325 |
| logSw: | -4.2262 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.938 |
| InChI Key: | YMHSTXKMQOYHHR-UHFFFAOYSA-N |