N-butyl-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-butyl-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
N-butyl-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | P508-1525 |
| Compound Name: | N-butyl-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 326.36 |
| Molecular Formula: | C16 H18 N6 O2 |
| Smiles: | CCCCNC(c1nc(c2cn(c3ccc(C)cc3)nn2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9225 |
| logD: | 2.9225 |
| logSw: | -3.1594 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.807 |
| InChI Key: | VEVTWZJEPIBXNF-UHFFFAOYSA-N |