N-(4-bromo-2-fluorophenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(4-bromo-2-fluorophenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E514-0568 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 449.3 |
| Molecular Formula: | C18 H14 Br F N4 O2 S |
| Smiles: | Cc1nnc(c2cc3c(cc(C)o3)n12)SCC(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7122 |
| logD: | 3.7002 |
| logSw: | -3.9683 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.534 |
| InChI Key: | DJXGBNUHHXLSLA-UHFFFAOYSA-N |