1-{2-[1-(3-cyanobenzoyl)piperidin-2-yl]ethyl}-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{2-[1-(3-cyanobenzoyl)piperidin-2-yl]ethyl}-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide
1-{2-[1-(3-cyanobenzoyl)piperidin-2-yl]ethyl}-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | T505-1219 |
| Compound Name: | 1-{2-[1-(3-cyanobenzoyl)piperidin-2-yl]ethyl}-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C21 H24 N6 O2 |
| Smiles: | C1CCN(C(C1)CCn1cc(C(NC2CC2)=O)nn1)C(c1cccc(C#N)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5541 |
| logD: | 1.554 |
| logSw: | -1.9953 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.55 |
| InChI Key: | MNNJCBKYPCPAFT-GOSISDBHSA-N |