2-[5-amino-3-(ethylsulfanyl)-4-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[5-amino-3-(ethylsulfanyl)-4-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[5-amino-3-(ethylsulfanyl)-4-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G196-0887 |
| Compound Name: | 2-[5-amino-3-(ethylsulfanyl)-4-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 476.64 |
| Molecular Formula: | C21 H24 N4 O3 S3 |
| Smiles: | CCSc1c(c(N)n(CC(Nc2cccc(c2)SC)=O)n1)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7625 |
| logD: | 3.7625 |
| logSw: | -3.8918 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.976 |
| InChI Key: | KQLNGIVFYDOXDQ-UHFFFAOYSA-N |