4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(4-fluorobenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | S517-1010 |
| Compound Name: | 4-[(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: | C1CN(CCC1Cc1nncn1Cc1ccccc1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2824 |
| logD: | 3.2823 |
| logSw: | -3.5074 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.01 |
| InChI Key: | XAEJQHCBSMPTSW-UHFFFAOYSA-N |