4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(4-ethylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(4-ethylphenyl)methyl]benzamide
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(4-ethylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | E856-3237 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(4-ethylphenyl)methyl]benzamide |
| Molecular Weight: | 499.01 |
| Molecular Formula: | C29 H27 Cl N4 O2 |
| Smiles: | CCc1ccc(CNC(c2ccc(CN3C(CCn4c3cc(c3ccc(cc3)[Cl])n4)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9449 |
| logD: | 5.9449 |
| logSw: | -6.1335 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.434 |
| InChI Key: | LCQWEJIOFMMPMQ-UHFFFAOYSA-N |