N-(3-fluoro-4-methylphenyl)-N'-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-N'-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(3-fluoro-4-methylphenyl)-N'-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | F781-0262 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-N'-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C23 H23 F N6 O S |
| Smiles: | CCCc1c(C)nc2ncnn2c1Sc1ccccc1NC(Nc1ccc(C)c(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8688 |
| logD: | 5.8687 |
| logSw: | -5.4573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.901 |
| InChI Key: | KOKHUDRRPZJFNJ-UHFFFAOYSA-N |