2-methoxy-1-[3-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-methoxy-1-[3-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]ethan-1-one
2-methoxy-1-[3-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | T629-2109 |
| Compound Name: | 2-methoxy-1-[3-(5-phenyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]ethan-1-one |
| Molecular Weight: | 300.36 |
| Molecular Formula: | C16 H20 N4 O2 |
| Smiles: | COCC(N1CCCC(C1)c1nnc(c2ccccc2)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9696 |
| logD: | 0.9444 |
| logSw: | -1.689 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.501 |
| InChI Key: | DZZUJVDZTXQSSN-ZDUSSCGKSA-N |