ethyl 6-{[(4-chlorophenyl)methyl]carbamoyl}-5-(4-ethoxyphenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 6-{[(4-chlorophenyl)methyl]carbamoyl}-5-(4-ethoxyphenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 6-{[(4-chlorophenyl)methyl]carbamoyl}-5-(4-ethoxyphenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
Compound ID: | E853-3732 |
Compound Name: | ethyl 6-{[(4-chlorophenyl)methyl]carbamoyl}-5-(4-ethoxyphenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
Molecular Weight: | 510.98 |
Molecular Formula: | C26 H27 Cl N4 O5 |
Smiles: | CCOC(c1cc2C(N(c3ccc(cc3)OCC)C(C)(Cn2n1)C(NCc1ccc(cc1)[Cl])=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6376 |
logD: | 3.6376 |
logSw: | -3.9975 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.011 |
InChI Key: | ABSLCILIYPFTBG-SANMLTNESA-N |