N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
Compound ID: | J015-0109 |
Compound Name: | N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
Molecular Weight: | 427.28 |
Molecular Formula: | C17 H11 Br N6 O S |
Smiles: | c1cc(C(Nc2nc(cs2)c2ccc(cc2)[Br])=O)nc(c1)n1cnnc1 |
Stereo: | ACHIRAL |
logP: | 4.5493 |
logD: | 4.5487 |
logSw: | -4.6113 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.215 |
InChI Key: | XFMCBYZSPUOVHH-UHFFFAOYSA-N |