N~2~-[(2-bromophenyl)methyl]-5,6-dimethyl-N~6~-(3-methylbutyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of
N~2~-[(2-bromophenyl)methyl]-5,6-dimethyl-N~6~-(3-methylbutyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
N~2~-[(2-bromophenyl)methyl]-5,6-dimethyl-N~6~-(3-methylbutyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Compound characteristics
| Compound ID: | E852-1057 |
| Compound Name: | N~2~-[(2-bromophenyl)methyl]-5,6-dimethyl-N~6~-(3-methylbutyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide |
| Molecular Weight: | 490.4 |
| Molecular Formula: | C22 H28 Br N5 O3 |
| Smiles: | CC(C)CCNC(C1(C)Cn2c(cc(C(NCc3ccccc3[Br])=O)n2)C(N1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8701 |
| logD: | 2.8701 |
| logSw: | -3.2625 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.309 |
| InChI Key: | IZHLSWUBEDGLDK-QFIPXVFZSA-N |