2-[(5-ethyl-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(5-ethyl-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide
2-[(5-ethyl-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E513-1140 |
| Compound Name: | 2-[(5-ethyl-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C20 H19 F N4 O S2 |
| Smiles: | CCc1nnc(c2cc3c(cc(C)s3)n12)SCC(Nc1ccc(C)c(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9809 |
| logD: | 4.9781 |
| logSw: | -4.6319 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.463 |
| InChI Key: | JXEIHTYXMFPSDR-UHFFFAOYSA-N |