4-[(4-methoxyphenyl)methyl]-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-[(4-methoxyphenyl)methyl]-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
4-[(4-methoxyphenyl)methyl]-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S383-1878 |
| Compound Name: | 4-[(4-methoxyphenyl)methyl]-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C25 H30 N4 O3 |
| Smiles: | CCC(C(N1CCC(CC1)C1=NNC(N1Cc1ccc(cc1)OC)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4439 |
| logD: | 4.4432 |
| logSw: | -4.1222 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.939 |
| InChI Key: | INRIUMNYZOCVGY-JOCHJYFZSA-N |