methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D549-0311 |
| Compound Name: | methyl {[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 397.48 |
| Molecular Formula: | C18 H15 N5 O2 S2 |
| Smiles: | COC(CSc1nnc(c2c(c3cccnc3s2)N)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7266 |
| logD: | 2.7266 |
| logSw: | -2.9635 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.102 |
| InChI Key: | RHRYZGXKPPHENF-UHFFFAOYSA-N |