1-phenyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-phenyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,4-triazole-3-carboxamide
1-phenyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V014-7335 |
| Compound Name: | 1-phenyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 306.37 |
| Molecular Formula: | C18 H18 N4 O |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC(c1ncn(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0353 |
| logD: | 4.0353 |
| logSw: | -4.1646 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.269 |
| InChI Key: | MSRYULZNNZNNAN-UHFFFAOYSA-N |