1-[4-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(thiophen-2-yl)ethan-1-one
1-[4-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | T630-2324 |
| Compound Name: | 1-[4-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C19 H20 N4 O S |
| Smiles: | C1CN(CCC1c1nnc(c2ccccc2)[nH]1)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5674 |
| logD: | 2.5422 |
| logSw: | -2.798 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.891 |
| InChI Key: | BEDGGAAMTPZEOO-UHFFFAOYSA-N |