2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-phenylbutan-2-yl)acetamide
2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | F071-0855 |
| Compound Name: | 2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 497.02 |
| Molecular Formula: | C24 H25 Cl N6 O2 S |
| Smiles: | CC(CCc1ccccc1)NC(Cn1c(c(c(n1)SC)c1nc(c2ccc(cc2)[Cl])no1)N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9081 |
| logD: | 4.9081 |
| logSw: | -5.2468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.645 |
| InChI Key: | IIXNPOGDFSZOHK-HNNXBMFYSA-N |