N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0068 |
| Compound Name: | N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 439.52 |
| Molecular Formula: | C25 H25 N7 O |
| Smiles: | C1CN(CCN1Cc1ccccc1)c1ccc(cc1)NC(c1cccc(n1)n1cnnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.292 |
| logD: | 3.1855 |
| logSw: | -3.4153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.434 |
| InChI Key: | VQRPZDWMDQPIJR-UHFFFAOYSA-N |