2-(9-tert-butyl-3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(3,4-difluorophenyl)acetamide
Chemical Structure Depiction of
2-(9-tert-butyl-3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(3,4-difluorophenyl)acetamide
2-(9-tert-butyl-3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(3,4-difluorophenyl)acetamide
Compound characteristics
| Compound ID: | F815-0972 |
| Compound Name: | 2-(9-tert-butyl-3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(3,4-difluorophenyl)acetamide |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C23 H23 F2 N5 O2 S |
| Smiles: | CC(C)(C)C1CCc2c3C4=NN(CC(Nc5ccc(c(c5)F)F)=O)C(N4C=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1326 |
| logD: | 5.1302 |
| logSw: | -5.1434 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.66 |
| InChI Key: | CRFFNPXYRDTPEP-GFCCVEGCSA-N |