ethyl 2-{2-[(5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[(5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamido}benzoate
ethyl 2-{2-[(5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | E514-0854 |
| Compound Name: | ethyl 2-{2-[(5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | CCc1nnc(c2cc3c(cc(C)o3)n12)SCC(Nc1ccccc1C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9301 |
| logD: | 3.911 |
| logSw: | -3.9335 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.486 |
| InChI Key: | ICMFTLFZBNPXES-UHFFFAOYSA-N |