2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
Chemical Structure Depiction of
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
Compound characteristics
| Compound ID: | D549-2478 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide |
| Molecular Weight: | 464.61 |
| Molecular Formula: | C23 H24 N6 O S2 |
| Smiles: | Cc1ccccc1n1c(c2c(c3cccnc3s2)N)nnc1SCC(NC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0278 |
| logD: | 4.0278 |
| logSw: | -4.193 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.513 |
| InChI Key: | NKGGMPVSHRIDHN-UHFFFAOYSA-N |