3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | T501-0690 |
| Compound Name: | 3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C21 H23 F N4 O2 S |
| Smiles: | C1CC(Cc2nncn2Cc2ccccc2)CN(C1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0365 |
| logD: | 3.0364 |
| logSw: | -3.3884 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.944 |
| InChI Key: | AQULKJYXGCIZBJ-GOSISDBHSA-N |