4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
Chemical Structure Depiction of
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
Compound characteristics
| Compound ID: | E856-3013 |
| Compound Name: | 4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide |
| Molecular Weight: | 488.95 |
| Molecular Formula: | C27 H22 Cl F N4 O2 |
| Smiles: | C1Cn2c(cc(c3cccc(c3)[Cl])n2)N(Cc2ccc(cc2)C(NCc2ccccc2F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.3331 |
| logD: | 5.3331 |
| logSw: | -5.9113 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.434 |
| InChI Key: | GQKXVZJMRFGCBU-UHFFFAOYSA-N |