N~6~-[(4-fluorophenyl)methyl]-N~2~-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of
N~6~-[(4-fluorophenyl)methyl]-N~2~-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
N~6~-[(4-fluorophenyl)methyl]-N~2~-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Compound characteristics
| Compound ID: | E852-5631 |
| Compound Name: | N~6~-[(4-fluorophenyl)methyl]-N~2~-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide |
| Molecular Weight: | 499.56 |
| Molecular Formula: | C24 H26 F N5 O4 S |
| Smiles: | CC1(Cn2c(cc(C(NCCSCc3ccco3)=O)n2)C(N1C)=O)C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0654 |
| logD: | 2.0654 |
| logSw: | -2.7858 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.786 |
| InChI Key: | RTCLQNDWVLZGGQ-DEOSSOPVSA-N |