N~2~-[3-(azepan-1-yl)propyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of
N~2~-[3-(azepan-1-yl)propyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
N~2~-[3-(azepan-1-yl)propyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Compound characteristics
| Compound ID: | E852-2419 |
| Compound Name: | N~2~-[3-(azepan-1-yl)propyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C26 H35 F N6 O3 |
| Smiles: | CC1(Cn2c(cc(C(NCCCN3CCCCCC3)=O)n2)C(N1C)=O)C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7991 |
| logD: | -0.7716 |
| logSw: | -2.3192 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.351 |
| InChI Key: | AEEFCAFOEWQVBW-SANMLTNESA-N |