2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-[(4-fluorophenyl)methyl]acetamide
2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F071-0717 |
| Compound Name: | 2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C22 H21 F N6 O2 S |
| Smiles: | Cc1ccc(cc1)c1nc(c2c(nn(CC(NCc3ccc(cc3)F)=O)c2N)SC)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.8148 |
| logD: | 3.8148 |
| logSw: | -4.285 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.203 |
| InChI Key: | JSVCIYZRJMKEDU-UHFFFAOYSA-N |