4-{3-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]azetidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{3-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]azetidine-1-carbonyl}benzonitrile
4-{3-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]azetidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S724-0377 |
| Compound Name: | 4-{3-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]azetidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 350.38 |
| Molecular Formula: | C18 H18 N6 O2 |
| Smiles: | C1CCN(C1)C(c1cn(C2CN(C2)C(c2ccc(C#N)cc2)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4106 |
| logD: | 0.4106 |
| logSw: | -1.2262 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 77.161 |
| InChI Key: | QJYUNSZRBGKPHW-UHFFFAOYSA-N |