N-(2-chlorophenyl)-N'-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(2-chlorophenyl)-N'-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(2-chlorophenyl)-N'-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | C301-9185 |
| Compound Name: | N-(2-chlorophenyl)-N'-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C20 H17 Cl N6 O S |
| Smiles: | Cc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(Nc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5668 |
| logD: | 4.5667 |
| logSw: | -4.4953 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.901 |
| InChI Key: | JJPPJKKNDOIRPH-UHFFFAOYSA-N |