N-[(4-methylphenyl)methyl]-2-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
N-[(4-methylphenyl)methyl]-2-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
Compound characteristics
Compound ID: | M754-1267 |
Compound Name: | N-[(4-methylphenyl)methyl]-2-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidine-1-carboxamide |
Molecular Weight: | 375.47 |
Molecular Formula: | C22 H25 N5 O |
Smiles: | Cc1ccc(CNC(N2CCCCC2c2nnc(c3ccccc3)[nH]2)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.5159 |
logD: | 3.4804 |
logSw: | -3.4231 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.237 |
InChI Key: | YVSQURJJJSUYKE-IBGZPJMESA-N |