3-fluoro-N-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
3-fluoro-N-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
3-fluoro-N-{2-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | F518-0383 |
| Compound Name: | 3-fluoro-N-{2-[(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)nc2ncnn2c1Sc1ccccc1NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8885 |
| logD: | 4.8884 |
| logSw: | -4.6375 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.689 |
| InChI Key: | HHGXNYOQUCDAQD-UHFFFAOYSA-N |