2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopropylacetamide
Chemical Structure Depiction of
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopropylacetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopropylacetamide
Compound characteristics
| Compound ID: | D549-1051 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopropylacetamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C20 H17 F N6 O S2 |
| Smiles: | C1CC1NC(CSc1nnc(c2c(c3cccnc3s2)N)n1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8246 |
| logD: | 2.8245 |
| logSw: | -3.2366 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.779 |
| InChI Key: | QRULHSBMDFWARQ-UHFFFAOYSA-N |