2-(5-{[(3-fluoro-4-methoxyphenyl)methyl]sulfanyl}-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
Chemical Structure Depiction of
2-(5-{[(3-fluoro-4-methoxyphenyl)methyl]sulfanyl}-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
2-(5-{[(3-fluoro-4-methoxyphenyl)methyl]sulfanyl}-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
Compound characteristics
| Compound ID: | D549-2182 |
| Compound Name: | 2-(5-{[(3-fluoro-4-methoxyphenyl)methyl]sulfanyl}-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine |
| Molecular Weight: | 467.54 |
| Molecular Formula: | C22 H18 F N5 O2 S2 |
| Smiles: | COc1ccc(CSc2nnc(c3c(c4cccnc4s3)N)n2Cc2ccco2)cc1F |
| Stereo: | ACHIRAL |
| logP: | 4.3869 |
| logD: | 4.3853 |
| logSw: | -4.5539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.887 |
| InChI Key: | UDTPVBRUPGIJIW-UHFFFAOYSA-N |