N-phenyl-4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
Chemical Structure Depiction of
N-phenyl-4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
N-phenyl-4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S564-0489 |
| Compound Name: | N-phenyl-4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide |
| Molecular Weight: | 361.45 |
| Molecular Formula: | C21 H23 N5 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccccc2)[nH]1)C(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5441 |
| logD: | 3.5083 |
| logSw: | -3.5745 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.211 |
| InChI Key: | PYFUSBXVRQHSQH-UHFFFAOYSA-N |