5-butyl-N~6~-cyclopentyl-6-methyl-N~2~-[3-(methylsulfanyl)phenyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of
5-butyl-N~6~-cyclopentyl-6-methyl-N~2~-[3-(methylsulfanyl)phenyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
5-butyl-N~6~-cyclopentyl-6-methyl-N~2~-[3-(methylsulfanyl)phenyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Compound characteristics
| Compound ID: | E852-4585 |
| Compound Name: | 5-butyl-N~6~-cyclopentyl-6-methyl-N~2~-[3-(methylsulfanyl)phenyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C25 H33 N5 O3 S |
| Smiles: | CCCCN1C(c2cc(C(Nc3cccc(c3)SC)=O)nn2CC1(C)C(NC1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0944 |
| logD: | 4.0942 |
| logSw: | -3.9437 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.177 |
| InChI Key: | HVQMCKLYSMMBKQ-VWLOTQADSA-N |