N-[3-(methylsulfanyl)phenyl]-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
N-[3-(methylsulfanyl)phenyl]-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | P431-1242 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-N'-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C19 H21 N7 O S |
| Smiles: | CSc1cccc(c1)NC(Nc1cnn(c1)c1ncc(cn1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2644 |
| logD: | 3.2643 |
| logSw: | -3.4817 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.259 |
| InChI Key: | GYLVSYBWALCTSM-UHFFFAOYSA-N |