2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(5-chloro-2,4-dimethoxyphenyl)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-(5-chloro-2,4-dimethoxyphenyl)acetamide
2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F071-0299 |
| Compound Name: | 2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 514.99 |
| Molecular Formula: | C23 H23 Cl N6 O4 S |
| Smiles: | Cc1ccc(cc1)c1nc(c2c(nn(CC(Nc3cc(c(cc3OC)OC)[Cl])=O)c2N)SC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.5069 |
| logD: | 4.4998 |
| logSw: | -4.8166 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.444 |
| InChI Key: | DTEFGXYNIDDKAE-UHFFFAOYSA-N |