N-[4-(methylsulfanyl)phenyl]-N'-{1-[5-(piperidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-[4-(methylsulfanyl)phenyl]-N'-{1-[5-(piperidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
N-[4-(methylsulfanyl)phenyl]-N'-{1-[5-(piperidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | P431-1370 |
| Compound Name: | N-[4-(methylsulfanyl)phenyl]-N'-{1-[5-(piperidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C20 H23 N7 O S |
| Smiles: | CSc1ccc(cc1)NC(Nc1cnn(c1)c1ncc(cn1)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6433 |
| logD: | 3.6433 |
| logSw: | -3.7308 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.893 |
| InChI Key: | IHFPPFSOILJTOD-UHFFFAOYSA-N |