2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F071-0691 |
| Compound Name: | 2-[5-amino-3-(methylsulfanyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazol-1-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 480.54 |
| Molecular Formula: | C23 H24 N6 O4 S |
| Smiles: | COc1cccc(CNC(Cn2c(c(c(n2)SC)c2nc(c3ccccc3)no2)N)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3983 |
| logD: | 3.3983 |
| logSw: | -3.872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.551 |
| InChI Key: | YFCDMNNHZCZFMH-UHFFFAOYSA-N |