4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(pyridin-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(pyridin-2-yl)methyl]benzamide
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(pyridin-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E856-2902 |
| Compound Name: | 4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[(pyridin-2-yl)methyl]benzamide |
| Molecular Weight: | 471.95 |
| Molecular Formula: | C26 H22 Cl N5 O2 |
| Smiles: | C1Cn2c(cc(c3cccc(c3)[Cl])n2)N(Cc2ccc(cc2)C(NCc2ccccn2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.0489 |
| logD: | 4.0488 |
| logSw: | -4.4484 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.977 |
| InChI Key: | OTOWNEFPAVAZCV-UHFFFAOYSA-N |