2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Compound characteristics
Compound ID: | D549-1960 |
Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide |
Molecular Weight: | 428.51 |
Molecular Formula: | C19 H17 F N6 O S2 |
Smiles: | CCn1c(c2c(c3cccnc3s2)N)nnc1SCC(Nc1cccc(c1)F)=O |
Stereo: | ACHIRAL |
logP: | 3.4235 |
logD: | 3.4217 |
logSw: | -3.8392 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 76.654 |
InChI Key: | LGLXAVOQPRQWIN-UHFFFAOYSA-N |