4-(azepane-1-sulfonyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)benzamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)benzamide
4-(azepane-1-sulfonyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G837-0061 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)benzamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CCOc1cccc2c1nc(NC(c1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.7264 |
| logD: | 4.7241 |
| logSw: | -4.2198 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.114 |
| InChI Key: | ISSMBDSQZWKKMT-UHFFFAOYSA-N |