methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D549-0059 |
| Compound Name: | methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C13 H13 N5 O2 S2 |
| Smiles: | Cn1c(c2c(c3cccnc3s2)N)nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.2755 |
| logD: | 1.274 |
| logSw: | -2.1064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.44 |
| InChI Key: | JVRIQIWKPZRYJC-UHFFFAOYSA-N |