N-[4-(methylsulfanyl)phenyl]-N'-{3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]phenyl}urea
Chemical Structure Depiction of
N-[4-(methylsulfanyl)phenyl]-N'-{3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]phenyl}urea
N-[4-(methylsulfanyl)phenyl]-N'-{3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]phenyl}urea
Compound characteristics
| Compound ID: | P130-0201 |
| Compound Name: | N-[4-(methylsulfanyl)phenyl]-N'-{3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]phenyl}urea |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C22 H23 N5 O S |
| Smiles: | CSc1ccc(cc1)NC(Nc1cccc(c1)c1c(nccn1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4449 |
| logD: | 5.4449 |
| logSw: | -5.3698 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.887 |
| InChI Key: | UAGVWNVCBDTGAX-UHFFFAOYSA-N |