N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[(4-fluorophenyl)methyl]urea
Chemical Structure Depiction of
N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[(4-fluorophenyl)methyl]urea
N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[(4-fluorophenyl)methyl]urea
Compound characteristics
| Compound ID: | L282-0208 |
| Compound Name: | N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-[(4-fluorophenyl)methyl]urea |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C22 H21 F N6 O S |
| Smiles: | CCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2593 |
| logD: | 4.2592 |
| logSw: | -4.227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.921 |
| InChI Key: | ISIXBPLOTWXJCK-UHFFFAOYSA-N |