N-(3-acetylphenyl)-N'-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(3-acetylphenyl)-N'-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(3-acetylphenyl)-N'-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | L282-0161 |
| Compound Name: | N-(3-acetylphenyl)-N'-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C23 H22 N6 O2 S |
| Smiles: | CCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(Nc1cccc(c1)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7546 |
| logD: | 4.7545 |
| logSw: | -4.5706 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.425 |
| InChI Key: | WVDNOPJOYUCRPQ-UHFFFAOYSA-N |