3-fluoro-N-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
3-fluoro-N-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
3-fluoro-N-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | L281-0439 |
| Compound Name: | 3-fluoro-N-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C22 H20 F N5 O S |
| Smiles: | CCCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0503 |
| logD: | 5.0494 |
| logSw: | -4.7425 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.387 |
| InChI Key: | DTSHJYZEQPTOHZ-UHFFFAOYSA-N |