1-phenyl-N-(propan-2-yl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-phenyl-N-(propan-2-yl)-1H-1,2,4-triazole-3-carboxamide
1-phenyl-N-(propan-2-yl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V001-2227 |
| Compound Name: | 1-phenyl-N-(propan-2-yl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 230.27 |
| Molecular Formula: | C12 H14 N4 O |
| Smiles: | CC(C)NC(c1ncn(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5504 |
| logD: | 1.5504 |
| logSw: | -1.9855 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.837 |
| InChI Key: | VLNOXKHUGUAXGH-UHFFFAOYSA-N |