N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-1485 |
| Compound Name: | N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-ethoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 454.42 |
| Molecular Formula: | C21 H24 Cl N3 O2 S |
| Salt: | HCl |
| Smiles: | CCOc1ccc(cc1)C(N(CCCN(C)C)c1nc2c(cccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6262 |
| logD: | 2.4784 |
| logSw: | -4.6805 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.135 |
| InChI Key: | OIOIKRPAXRFYBH-UHFFFAOYSA-N |