2-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Chemical Structure Depiction of
2-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
2-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Compound characteristics
| Compound ID: | G279-0198 |
| Compound Name: | 2-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide |
| Molecular Weight: | 452.6 |
| Molecular Formula: | C23 H24 N4 O2 S2 |
| Smiles: | Cc1c2c(n(c3ccccc3)n1)SCC(N2CC(NCCc1ccc(cc1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9826 |
| logD: | 2.9826 |
| logSw: | -3.2742 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.881 |
| InChI Key: | YBNXXTPUZOYNHK-UHFFFAOYSA-N |