3-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
3-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}benzonitrile
3-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S457-0863 |
| Compound Name: | 3-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 389.42 |
| Molecular Formula: | C20 H19 N7 O2 |
| Smiles: | C1CC(CN(C1)C(c1cccc(C#N)c1)=O)n1cc(c2nc(C3CC3)no2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7685 |
| logD: | 1.7685 |
| logSw: | -1.8763 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 91.812 |
| InChI Key: | PAIURSPGPGYOQA-INIZCTEOSA-N |