2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-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-(4-chloro-3-fluorophenyl)acetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-3-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | D549-1958 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-3-fluorophenyl)acetamide |
| Molecular Weight: | 462.95 |
| Molecular Formula: | C19 H16 Cl F N6 O S2 |
| Smiles: | CCn1c(c2c(c3cccnc3s2)N)nnc1SCC(Nc1ccc(c(c1)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9776 |
| logD: | 3.9679 |
| logSw: | -4.2703 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.654 |
| InChI Key: | FZGNNZWFRMNHDI-UHFFFAOYSA-N |