2-[(7-tert-butyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[(7-tert-butyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-diethylacetamide
2-[(7-tert-butyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-diethylacetamide
Compound characteristics
| Compound ID: | 8010-1051 |
| Compound Name: | 2-[(7-tert-butyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-diethylacetamide |
| Molecular Weight: | 483.69 |
| Molecular Formula: | C26 H33 N3 O2 S2 |
| Smiles: | CCN(CC)C(CSC1=Nc2c(C(N1c1ccccc1)=O)c1CCC(Cc1s2)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6015 |
| logD: | 5.6015 |
| logSw: | -5.4368 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.659 |
| InChI Key: | SNQRYDJWYDFFPQ-QGZVFWFLSA-N |