3-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)propanamide--hydrogen chloride (1/1)
3-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-2413 |
| Compound Name: | 3-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 496.09 |
| Molecular Formula: | C23 H29 N3 O3 S2 |
| Salt: | HCl |
| Smiles: | Cc1cc(C)c2c(c1)nc(N(CCCN(C)C)C(CCS(c1ccccc1)(=O)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.2085 |
| logD: | 2.003 |
| logSw: | -4.2182 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.749 |
| InChI Key: | PVXSOTBYHOILEU-UHFFFAOYSA-N |