2-[5-amino-4-(4-fluorobenzene-1-sulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Chemical Structure Depiction of
2-[5-amino-4-(4-fluorobenzene-1-sulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
2-[5-amino-4-(4-fluorobenzene-1-sulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Compound characteristics
| Compound ID: | G196-1366 |
| Compound Name: | 2-[5-amino-4-(4-fluorobenzene-1-sulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C20 H19 F N4 O5 S2 |
| Smiles: | CSc1c(c(N)n(CC(Nc2ccc3c(c2)OCCO3)=O)n1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4928 |
| logD: | 1.4927 |
| logSw: | -2.617 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.799 |
| InChI Key: | BMFIWVUJWPYPGQ-UHFFFAOYSA-N |