{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
Chemical Structure Depiction of
{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
Compound characteristics
| Compound ID: | S564-0393 |
| Compound Name: | {4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone |
| Molecular Weight: | 397.48 |
| Molecular Formula: | C24 H23 N5 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccccc2)[nH]1)C(c1ccc2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0943 |
| logD: | 4.0585 |
| logSw: | -4.5301 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.721 |
| InChI Key: | ZQKBZSRDQNOVFB-UHFFFAOYSA-N |