3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[(oxolan-2-yl)methyl]propanamide
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | F145-1021 |
| Compound Name: | 3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CC(C)(C)C1CCc2c3C(NC(CCC(NCC4CCCO4)=O)=Nc3sc2C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9186 |
| logD: | 2.918 |
| logSw: | -3.1583 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.849 |
| InChI Key: | IROHIWZYALWOPN-UHFFFAOYSA-N |