N-butyl-1-phenyl-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-butyl-1-phenyl-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
N-butyl-1-phenyl-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D731-0034 |
| Compound Name: | N-butyl-1-phenyl-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C16 H22 N4 O |
| Smiles: | CCCCNC(c1c(C(C)C)n(c2ccccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4929 |
| logD: | 3.4929 |
| logSw: | -3.5323 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.637 |
| InChI Key: | YBTLGDFDXHNTKZ-UHFFFAOYSA-N |