N-(4-bromophenyl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
N-(4-bromophenyl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | P508-0759 |
| Compound Name: | N-(4-bromophenyl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 425.24 |
| Molecular Formula: | C18 H13 Br N6 O2 |
| Smiles: | Cc1ccc(cc1)n1cc(c2nc(C(Nc3ccc(cc3)[Br])=O)on2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.271 |
| logD: | 4.2673 |
| logSw: | -4.2471 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.372 |
| InChI Key: | DXGZNAWFTLRJLR-UHFFFAOYSA-N |