{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
Chemical Structure Depiction of
{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
Compound characteristics
| Compound ID: | S517-1173 |
| Compound Name: | {4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone |
| Molecular Weight: | 486.64 |
| Molecular Formula: | C24 H34 N6 O3 S |
| Smiles: | C1CCN(C1)S(N1CCCC(C1)C(N1CCC(CC1)Cc1nncn1c1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.715 |
| logD: | 1.7147 |
| logSw: | -2.3376 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.823 |
| InChI Key: | HDLKGYDLAFHOOI-NRFANRHFSA-N |