N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-methylbenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-methylbenzamide--hydrogen chloride (1/1)
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-methylbenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-0639 |
| Compound Name: | N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-methylbenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 468.84 |
| Molecular Formula: | C20 H22 Br N3 O S |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)C(N(CCCN(C)C)c1nc2ccc(cc2s1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8716 |
| logD: | 2.7237 |
| logSw: | -4.6626 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.2405 |
| InChI Key: | NJIFISOYPXEOCF-UHFFFAOYSA-N |