2-{5-amino-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chlorophenyl)acetamide
Chemical Structure Depiction of
2-{5-amino-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chlorophenyl)acetamide
2-{5-amino-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | F071-0311 |
| Compound Name: | 2-{5-amino-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chlorophenyl)acetamide |
| Molecular Weight: | 470.94 |
| Molecular Formula: | C21 H19 Cl N6 O3 S |
| Smiles: | COc1ccc(cc1)c1nc(c2c(nn(CC(Nc3cccc(c3)[Cl])=O)c2N)SC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.5206 |
| logD: | 4.5205 |
| logSw: | -4.8141 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.425 |
| InChI Key: | YONNWXKMLKDQIR-UHFFFAOYSA-N |