{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(thiophen-3-yl)methanone
Chemical Structure Depiction of
{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(thiophen-3-yl)methanone
{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | S564-0402 |
| Compound Name: | {4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(thiophen-3-yl)methanone |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C19 H20 N4 O S |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccccc2)[nH]1)C(c1ccsc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.19 |
| logD: | 3.1542 |
| logSw: | -3.2528 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.409 |
| InChI Key: | CKFSPRCTCCXRLC-UHFFFAOYSA-N |