N-(5-chloro-2,4-dimethoxyphenyl)-N'-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | L282-0734 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 498.99 |
| Molecular Formula: | C23 H23 Cl N6 O3 S |
| Smiles: | CCc1cc(n2c(n1)nc(C)n2)Sc1ccc(cc1)NC(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2083 |
| logD: | 5.207 |
| logSw: | -5.6325 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.976 |
| InChI Key: | KHTUWEMMKSBNOB-UHFFFAOYSA-N |