N-(3-chloro-4-fluorophenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
N-(3-chloro-4-fluorophenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | F798-0666 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide |
| Molecular Weight: | 489.93 |
| Molecular Formula: | C20 H13 Cl F N5 O3 S2 |
| Smiles: | C(c1ccco1)N1C(c2c(ccs2)n2c1nnc2SCC(Nc1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0911 |
| logD: | 4.0845 |
| logSw: | -4.4128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.229 |
| InChI Key: | JEXBPPUQBCLZNW-UHFFFAOYSA-N |