2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(4-phenylbutan-2-yl)acetamide
2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | C785-0126 |
| Compound Name: | 2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 380.47 |
| Molecular Formula: | C20 H20 N4 O2 S |
| Smiles: | CC(CCc1ccccc1)NC(CN1C(c2cc3c(ccs3)n2C=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6058 |
| logD: | 2.6058 |
| logSw: | -3.0571 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.615 |
| InChI Key: | JEMHPSLZOKVUIG-AWEZNQCLSA-N |