4-[3-(1-cyclopentyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Chemical Structure Depiction of
4-[3-(1-cyclopentyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
4-[3-(1-cyclopentyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Compound characteristics
| Compound ID: | G944-0644 |
| Compound Name: | 4-[3-(1-cyclopentyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile |
| Molecular Weight: | 356.39 |
| Molecular Formula: | C20 H16 N6 O |
| Smiles: | C1CCC(C1)n1c2ccc(cc2nn1)c1nc(c2ccc(C#N)cc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2483 |
| logD: | 4.2483 |
| logSw: | -4.4324 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 74.462 |
| InChI Key: | NSPAZGAWSQNUGX-UHFFFAOYSA-N |