[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl](3-methylthiophen-2-yl)methanone
Chemical Structure Depiction of
[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl](3-methylthiophen-2-yl)methanone
[4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl](3-methylthiophen-2-yl)methanone
Compound characteristics
Compound ID: | T630-1585 |
Compound Name: | [4-(5-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl](3-methylthiophen-2-yl)methanone |
Molecular Weight: | 304.41 |
Molecular Formula: | C15 H20 N4 O S |
Smiles: | CCc1nnc(C2CCN(CC2)C(c2c(C)ccs2)=O)[nH]1 |
Stereo: | ACHIRAL |
logP: | 2.0848 |
logD: | 2.0824 |
logSw: | -2.5276 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.681 |
InChI Key: | SZXINDQIGCFGKH-UHFFFAOYSA-N |