3-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(2,5-dimethylphenyl)propanamide
Chemical Structure Depiction of
3-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(2,5-dimethylphenyl)propanamide
3-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(2,5-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | F952-2803 |
| Compound Name: | 3-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(2,5-dimethylphenyl)propanamide |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C24 H29 N3 O4 S2 |
| Smiles: | Cc1ccc(C)c(c1)NC(CCN1C(=O)Sc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3749 |
| logD: | 4.3749 |
| logSw: | -4.1898 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.283 |
| InChI Key: | PHGJWMZIXORUGQ-UHFFFAOYSA-N |