3-[(2-{2-[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)methyl]benzonitrile
Chemical Structure Depiction of
3-[(2-{2-[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)methyl]benzonitrile
3-[(2-{2-[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | T505-1053 |
| Compound Name: | 3-[(2-{2-[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)methyl]benzonitrile |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C22 H28 N6 O2 |
| Smiles: | C1CCN(Cc2cccc(C#N)c2)C(C1)CCn1cc(C(N2CCOCC2)=O)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3124 |
| logD: | 1.0432 |
| logSw: | -1.6792 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.888 |
| InChI Key: | YVQWCFAQDOOCRY-HXUWFJFHSA-N |