4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(2-fluorophenyl)benzamide
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(2-fluorophenyl)benzamide
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(2-fluorophenyl)benzamide
Compound characteristics
Compound ID: | E856-3142 |
Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(2-fluorophenyl)benzamide |
Molecular Weight: | 474.92 |
Molecular Formula: | C26 H20 Cl F N4 O2 |
Smiles: | C1Cn2c(cc(c3ccc(cc3)[Cl])n2)N(Cc2ccc(cc2)C(Nc2ccccc2F)=O)C1=O |
Stereo: | ACHIRAL |
logP: | 5.3267 |
logD: | 5.3203 |
logSw: | -5.9808 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.414 |
InChI Key: | GSXSXLHOSCUIHH-UHFFFAOYSA-N |