3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
Chemical Structure Depiction of
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
Compound characteristics
| Compound ID: | T501-0703 |
| Compound Name: | 3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine |
| Molecular Weight: | 428.56 |
| Molecular Formula: | C21 H28 N6 O2 S |
| Smiles: | Cc1c(c(C)n(C)n1)S(N1CCCC(Cc2nncn2Cc2ccccc2)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1172 |
| logD: | 1.1172 |
| logSw: | -2.2695 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.783 |
| InChI Key: | AIQXHBRLLHAFIK-LJQANCHMSA-N |