4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3-methoxyphenyl)benzamide
Chemical Structure Depiction of
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3-methoxyphenyl)benzamide
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3-methoxyphenyl)benzamide
Compound characteristics
| Compound ID: | E856-2906 |
| Compound Name: | 4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3-methoxyphenyl)benzamide |
| Molecular Weight: | 486.96 |
| Molecular Formula: | C27 H23 Cl N4 O3 |
| Smiles: | COc1cccc(c1)NC(c1ccc(CN2C(CCn3c2cc(c2cccc(c2)[Cl])n3)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3593 |
| logD: | 5.3585 |
| logSw: | -5.8978 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.656 |
| InChI Key: | WDPSCQSMVUTXLQ-UHFFFAOYSA-N |