ethyl 5-(3-chloro-2-methylphenyl)-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-(3-chloro-2-methylphenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 5-(3-chloro-2-methylphenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | C796-0701 |
| Compound Name: | ethyl 5-(3-chloro-2-methylphenyl)-6-methyl-6-[(3-methylbutyl)carbamoyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 460.96 |
| Molecular Formula: | C23 H29 Cl N4 O4 |
| Smiles: | CCOC(c1cc2C(N(c3cccc(c3C)[Cl])C(C)(Cn2n1)C(NCCC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8092 |
| logD: | 3.8092 |
| logSw: | -4.2463 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.699 |
| InChI Key: | KAJIVJTUPQWZFO-QHCPKHFHSA-N |