N-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
N-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | L282-0753 |
| Compound Name: | N-{4-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 472.49 |
| Molecular Formula: | C22 H19 F3 N6 O S |
| Smiles: | CCc1cc(n2c(n1)nc(C)n2)Sc1ccc(cc1)NC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9518 |
| logD: | 5.9516 |
| logSw: | -5.5847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.413 |
| InChI Key: | WPVZRPXUQPJGQW-UHFFFAOYSA-N |