ethyl 6-(benzylcarbamoyl)-5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 6-(benzylcarbamoyl)-5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 6-(benzylcarbamoyl)-5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | E853-2281 |
| Compound Name: | ethyl 6-(benzylcarbamoyl)-5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C25 H25 Cl N4 O4 |
| Smiles: | CCOC(c1cc2C(N(Cc3ccc(cc3)[Cl])C(C)(Cn2n1)C(NCc1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7342 |
| logD: | 3.7342 |
| logSw: | -4.259 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.499 |
| InChI Key: | KGRVQISFTCGLFJ-VWLOTQADSA-N |