2-{[(2-fluorophenyl)methyl]sulfanyl}-5-methyl-7-(pyridin-4-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-{[(2-fluorophenyl)methyl]sulfanyl}-5-methyl-7-(pyridin-4-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
2-{[(2-fluorophenyl)methyl]sulfanyl}-5-methyl-7-(pyridin-4-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C118-0464 |
| Compound Name: | 2-{[(2-fluorophenyl)methyl]sulfanyl}-5-methyl-7-(pyridin-4-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C19 H17 F N6 O S |
| Smiles: | [H]N([H])C(C1C(c2ccncc2)n2c(NC=1C)nc(n2)SCc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4868 |
| logD: | 2.485 |
| logSw: | -2.6284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.987 |
| InChI Key: | BGGAUSZCNMCGOT-INIZCTEOSA-N |