2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[1-(1-methyl-1H-benzimidazol-2-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[1-(1-methyl-1H-benzimidazol-2-yl)ethyl]acetamide
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[1-(1-methyl-1H-benzimidazol-2-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | G199-3158 |
| Compound Name: | 2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[1-(1-methyl-1H-benzimidazol-2-yl)ethyl]acetamide |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C23 H20 F N7 O2 S |
| Smiles: | CC(c1nc2ccccc2n1C)NC(CSC1=NC(c2ccccc2F)=NC2=CC(NN12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3865 |
| logD: | 2.3791 |
| logSw: | -2.9162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.578 |
| InChI Key: | DJCBIESWOKKQRK-ZDUSSCGKSA-N |