N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | L282-0124 |
| Compound Name: | N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 458.46 |
| Molecular Formula: | C21 H17 F3 N6 O S |
| Smiles: | Cc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5584 |
| logD: | 5.5582 |
| logSw: | -5.645 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.599 |
| InChI Key: | BDYWPTUCXSPQTP-UHFFFAOYSA-N |