1-(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-(thiophen-3-yl)ethan-1-one
1-(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | T501-0418 |
| Compound Name: | 1-(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 332.47 |
| Molecular Formula: | C17 H24 N4 O S |
| Smiles: | CC(C)n1cnnc1CC1CCCN(C1)C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.285 |
| logD: | 2.2845 |
| logSw: | -2.5826 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.435 |
| InChI Key: | JKNZSXNGOSQHTP-CQSZACIVSA-N |