5-bromo-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-bromo-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
5-bromo-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | E677-2707 |
Compound Name: | 5-bromo-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1) |
Molecular Weight: | 496.82 |
Molecular Formula: | C17 H16 Br F2 N3 O S2 |
Salt: | HCl |
Smiles: | CN(C)CCCN(C(c1ccc(s1)[Br])=O)c1nc2c(cc(cc2s1)F)F |
Stereo: | ACHIRAL |
logP: | 4.9264 |
logD: | 2.7786 |
logSw: | -4.6616 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 31.0293 |
InChI Key: | XWWDBPKBHDFEDJ-UHFFFAOYSA-N |