2-(9-methyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-(9-methyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-(4-phenylbutan-2-yl)acetamide
2-(9-methyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | L908-0330 |
| Compound Name: | 2-(9-methyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C24 H27 N5 O2 S |
| Smiles: | CC1CCc2c3C4=NC(N(CC(NC(C)CCc5ccccc5)=O)N4C=Nc3sc2C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1208 |
| logD: | -0.8132 |
| logSw: | -4.3979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.704 |
| InChI Key: | LDZJJWKWHIZRIN-UHFFFAOYSA-N |