N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-methoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-methoxybenzamide--hydrogen chloride (1/1)
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-methoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-0653 |
| Compound Name: | N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-methoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 484.84 |
| Molecular Formula: | C20 H22 Br N3 O2 S |
| Salt: | HCl |
| Smiles: | CN(C)CCCN(C(c1ccc(cc1)OC)=O)c1nc2ccc(cc2s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.5669 |
| logD: | 2.4191 |
| logSw: | -4.378 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.784 |
| InChI Key: | LBSKFPYSTWZERG-UHFFFAOYSA-N |