4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide
Chemical Structure Depiction of
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide
4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | E856-3003 |
| Compound Name: | 4-{[2-(3-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide |
| Molecular Weight: | 503.99 |
| Molecular Formula: | C27 H26 Cl N5 O3 |
| Smiles: | Cc1c(CCNC(c2ccc(CN3C(CCn4c3cc(c3cccc(c3)[Cl])n4)=O)cc2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.1241 |
| logD: | 4.1241 |
| logSw: | -4.4852 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.314 |
| InChI Key: | LLONEQVHITXNAC-UHFFFAOYSA-N |