4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3,4-dimethylphenyl)benzamide
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3,4-dimethylphenyl)benzamide
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3,4-dimethylphenyl)benzamide
Compound characteristics
| Compound ID: | E856-3171 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(3,4-dimethylphenyl)benzamide |
| Molecular Weight: | 484.99 |
| Molecular Formula: | C28 H25 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1C)NC(c1ccc(CN2C(CCn3c2cc(c2ccc(cc2)[Cl])n3)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3358 |
| logD: | 6.3357 |
| logSw: | -6.2243 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.112 |
| InChI Key: | ZITRRMVUIQYMDZ-UHFFFAOYSA-N |