5-bromo-N-[2-(dimethylamino)ethyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-bromo-N-[2-(dimethylamino)ethyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide--hydrogen chloride (1/1)
5-bromo-N-[2-(dimethylamino)ethyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | E676-2326 |
Compound Name: | 5-bromo-N-[2-(dimethylamino)ethyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide--hydrogen chloride (1/1) |
Molecular Weight: | 474.87 |
Molecular Formula: | C18 H20 Br N3 O S2 |
Salt: | HCl |
Smiles: | Cc1cc(C)c2c(c1)nc(N(CCN(C)C)C(c1ccc(s1)[Br])=O)s2 |
Stereo: | ACHIRAL |
logP: | 5.778 |
logD: | 5.3701 |
logSw: | -5.3309 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 30.2589 |
InChI Key: | KFVZJWFOTBRRBR-UHFFFAOYSA-N |