ethyl 5-(4-chlorophenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 5-(4-chlorophenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | C796-0647 |
| Compound Name: | ethyl 5-(4-chlorophenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C22 H27 Cl N4 O4 |
| Smiles: | CCOC(c1cc2C(N(c3ccc(cc3)[Cl])C(C)(Cn2n1)C(NCCC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2951 |
| logD: | 3.2951 |
| logSw: | -3.689 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74 |
| InChI Key: | BRJHYMHEONLQJI-QFIPXVFZSA-N |