(oxan-4-yl){4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Chemical Structure Depiction of
(oxan-4-yl){4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
(oxan-4-yl){4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Compound characteristics
Compound ID: | S564-0407 |
Compound Name: | (oxan-4-yl){4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone |
Molecular Weight: | 354.45 |
Molecular Formula: | C20 H26 N4 O2 |
Smiles: | C1CN(CCC1Cc1nnc(c2ccccc2)[nH]1)C(C1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 2.6541 |
logD: | 2.6183 |
logSw: | -2.883 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.491 |
InChI Key: | YIQQAQCZXYBUHL-UHFFFAOYSA-N |