2-methyl-4-phenyl-5-[1-(4-phenylbutanoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
2-methyl-4-phenyl-5-[1-(4-phenylbutanoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
2-methyl-4-phenyl-5-[1-(4-phenylbutanoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4574 |
| Compound Name: | 2-methyl-4-phenyl-5-[1-(4-phenylbutanoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | CN1C(N(C(C2CCCN(C2)C(CCCc2ccccc2)=O)=N1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9489 |
| logD: | 3.9488 |
| logSw: | -3.9752 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.539 |
| InChI Key: | CBUQUFDAXSTLME-FQEVSTJZSA-N |