(4-ethoxyphenyl)[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Chemical Structure Depiction of
(4-ethoxyphenyl)[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
(4-ethoxyphenyl)[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Compound characteristics
Compound ID: | T630-1587 |
Compound Name: | (4-ethoxyphenyl)[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone |
Molecular Weight: | 328.41 |
Molecular Formula: | C18 H24 N4 O2 |
Smiles: | CCc1nnc(C2CCN(CC2)C(c2ccc(cc2)OCC)=O)[nH]1 |
Stereo: | ACHIRAL |
logP: | 1.9516 |
logD: | 1.9492 |
logSw: | -2.3964 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.786 |
InChI Key: | XMTBNZOZULLVHA-UHFFFAOYSA-N |