N-[(4-chlorophenyl)methyl]-5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
N-[(4-chlorophenyl)methyl]-5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E223-3807 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide |
| Molecular Weight: | 426.88 |
| Molecular Formula: | C22 H20 Cl F N4 O2 |
| Smiles: | Cc1cc2C(N(c3ccc(cc3)F)C(C)(Cn2n1)C(NCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9597 |
| logD: | 2.9597 |
| logSw: | -3.5616 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.94 |
| InChI Key: | SMYYZFCVTCEXRK-QFIPXVFZSA-N |