ethyl 6-methyl-6-[(3-methylbutyl)carbamoyl]-5-(2-methylphenyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-6-[(3-methylbutyl)carbamoyl]-5-(2-methylphenyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 6-methyl-6-[(3-methylbutyl)carbamoyl]-5-(2-methylphenyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | C796-0665 |
| Compound Name: | ethyl 6-methyl-6-[(3-methylbutyl)carbamoyl]-5-(2-methylphenyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C23 H30 N4 O4 |
| Smiles: | CCOC(c1cc2C(N(c3ccccc3C)C(C)(Cn2n1)C(NCCC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1284 |
| logD: | 3.1284 |
| logSw: | -3.2679 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.699 |
| InChI Key: | NBWFYDQEPJUFAW-QHCPKHFHSA-N |