1-{2-[1-(4-cyanobenzoyl)piperidin-2-yl]ethyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{2-[1-(4-cyanobenzoyl)piperidin-2-yl]ethyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{2-[1-(4-cyanobenzoyl)piperidin-2-yl]ethyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | T505-0629 |
| Compound Name: | 1-{2-[1-(4-cyanobenzoyl)piperidin-2-yl]ethyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C20 H24 N6 O2 |
| Smiles: | CN(C)C(c1cn(CCC2CCCCN2C(c2ccc(C#N)cc2)=O)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8106 |
| logD: | 0.8106 |
| logSw: | -1.2798 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 76.081 |
| InChI Key: | XOQMQBJNGJKUBP-QGZVFWFLSA-N |