3-{3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
3-{3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidine-1-carbonyl}benzonitrile
3-{3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S460-0207 |
| Compound Name: | 3-{3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 411.42 |
| Molecular Formula: | C22 H17 N7 O2 |
| Smiles: | C1CN(CC1n1cc(c2nc(c3ccccc3)no2)nn1)C(c1cccc(C#N)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.51 |
| logD: | 2.51 |
| logSw: | -2.6403 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 91.654 |
| InChI Key: | OGZVUSBBUDPNHY-GOSISDBHSA-N |