2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | D549-0223 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 494.64 |
| Molecular Formula: | C24 H26 N6 O2 S2 |
| Smiles: | COc1ccc(cc1)NC(CSc1nnc(c2c(c3cccnc3s2)N)n1C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5087 |
| logD: | 4.5071 |
| logSw: | -4.3107 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.777 |
| InChI Key: | UEDBZQNXCICLSF-UHFFFAOYSA-N |