5-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
5-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-2708 |
| Compound Name: | 5-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 452.37 |
| Molecular Formula: | C17 H16 Cl F2 N3 O S2 |
| Salt: | HCl |
| Smiles: | CN(C)CCCN(C(c1ccc(s1)[Cl])=O)c1nc2c(cc(cc2s1)F)F |
| Stereo: | ACHIRAL |
| logP: | 4.7795 |
| logD: | 2.6317 |
| logSw: | -4.8479 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.0293 |
| InChI Key: | ROVMWIPVLAOEPE-UHFFFAOYSA-N |