4-benzoyl-N-[3-(dimethylamino)propyl]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-benzoyl-N-[3-(dimethylamino)propyl]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
4-benzoyl-N-[3-(dimethylamino)propyl]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-0912 |
| Compound Name: | 4-benzoyl-N-[3-(dimethylamino)propyl]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 494.06 |
| Molecular Formula: | C27 H27 N3 O2 S |
| Salt: | HCl |
| Smiles: | Cc1cccc2c1nc(N(CCCN(C)C)C(c1ccc(cc1)C(c1ccccc1)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.3475 |
| logD: | 3.1997 |
| logSw: | -5.2448 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.478 |
| InChI Key: | YECRMDXCCWJQRQ-UHFFFAOYSA-N |