N-(3-bromophenyl)-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
N-(3-bromophenyl)-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | P508-0596 |
| Compound Name: | N-(3-bromophenyl)-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 411.22 |
| Molecular Formula: | C17 H11 Br N6 O2 |
| Smiles: | c1ccc(cc1)n1cc(c2nc(C(Nc3cccc(c3)[Br])=O)on2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.7002 |
| logD: | 3.6957 |
| logSw: | -3.9956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.372 |
| InChI Key: | KSWDTCKQUKBYPQ-UHFFFAOYSA-N |