N-(2-chloro-4-methylphenyl)-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
N-(2-chloro-4-methylphenyl)-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | P431-1188 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 397.87 |
| Molecular Formula: | C19 H20 Cl N7 O |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(Nc1cnn(c1)c1ncc(cn1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5282 |
| logD: | 3.5281 |
| logSw: | -3.584 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.561 |
| InChI Key: | OCOOVOAPEVDNAT-UHFFFAOYSA-N |