3-chloro-N-[3-(dimethylamino)propyl]-N-(4-fluoro-1,3-benzothiazol-2-yl)-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-N-[3-(dimethylamino)propyl]-N-(4-fluoro-1,3-benzothiazol-2-yl)-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
3-chloro-N-[3-(dimethylamino)propyl]-N-(4-fluoro-1,3-benzothiazol-2-yl)-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-1321 |
| Compound Name: | 3-chloro-N-[3-(dimethylamino)propyl]-N-(4-fluoro-1,3-benzothiazol-2-yl)-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 484.44 |
| Molecular Formula: | C21 H19 Cl F N3 O S2 |
| Salt: | HCl |
| Smiles: | CN(C)CCCN(C(c1c(c2ccccc2s1)[Cl])=O)c1nc2c(cccc2s1)F |
| Stereo: | ACHIRAL |
| logP: | 5.7049 |
| logD: | 3.5571 |
| logSw: | -5.7485 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.7578 |
| InChI Key: | FCBPZZFYLRYASX-UHFFFAOYSA-N |