2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclopentyl-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-cyclopentyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclopentyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
Compound characteristics
| Compound ID: | D549-1806 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-cyclopentyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide |
| Molecular Weight: | 442.6 |
| Molecular Formula: | C21 H26 N6 O S2 |
| Smiles: | C1CCC(C1)NC(CSc1nnc(c2c(c3cccnc3s2)N)n1C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4203 |
| logD: | 3.4187 |
| logSw: | -3.7622 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.013 |
| InChI Key: | RLQMMTMZRUODFQ-UHFFFAOYSA-N |