N-(4-bromophenyl)-N'-{2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-{2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(4-bromophenyl)-N'-{2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | C301-9292 |
| Compound Name: | N-(4-bromophenyl)-N'-{2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 455.33 |
| Molecular Formula: | C19 H15 Br N6 O S |
| Smiles: | Cc1cc(n2c(ncn2)n1)Sc1ccccc1NC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5566 |
| logD: | 4.5565 |
| logSw: | -4.3117 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.354 |
| InChI Key: | JPICSKGHJLPVLZ-UHFFFAOYSA-N |