2-({5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-[(oxolan-2-yl)methyl]-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-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
2-({5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | D549-2548 |
| Compound Name: | 2-({5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide |
| Molecular Weight: | 484.57 |
| Molecular Formula: | C22 H21 F N6 O2 S2 |
| Smiles: | C1CC(Cn2c(c3c(c4cccnc4s3)N)nnc2SCC(Nc2cccc(c2)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.168 |
| logD: | 3.1662 |
| logSw: | -3.2877 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.312 |
| InChI Key: | HUCQFUSLDMSOQJ-OAHLLOKOSA-N |