N-(2-fluorophenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(2-fluorophenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(2-fluorophenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | L282-0585 |
| Compound Name: | N-(2-fluorophenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C22 H21 F N6 O S |
| Smiles: | CCCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3592 |
| logD: | 5.359 |
| logSw: | -5.3329 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.901 |
| InChI Key: | IETAIFRNDRZUMD-UHFFFAOYSA-N |