2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F071-0246 |
| Compound Name: | 2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 500.96 |
| Molecular Formula: | C22 H21 Cl N6 O4 S |
| Smiles: | COc1cc(c(cc1NC(Cn1c(c(c(n1)SC)c1nc(c2ccccc2)no1)N)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.9784 |
| logD: | 3.9714 |
| logSw: | -4.6187 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.444 |
| InChI Key: | PGNZZGZXMBJRKJ-UHFFFAOYSA-N |