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-methylphenyl)methyl]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-methylphenyl)methyl]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-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L908-0308 |
| 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-methylphenyl)methyl]acetamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C22 H23 N5 O2 S |
| Smiles: | CC1CCc2c3C4=NC(N(CC(NCc5ccc(C)cc5)=O)N4C=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5932 |
| logD: | -1.3407 |
| logSw: | -3.9583 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.263 |
| InChI Key: | ZOZLUBKJDVCWFR-CQSZACIVSA-N |