2-(anthracen-9-yl)-7-tert-butyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-(anthracen-9-yl)-7-tert-butyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
2-(anthracen-9-yl)-7-tert-butyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 2829-4361 |
| Compound Name: | 2-(anthracen-9-yl)-7-tert-butyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 440.61 |
| Molecular Formula: | C28 H28 N2 O S |
| Smiles: | CC(C)(C)C1CCc2c3C(NC(c4c5ccccc5cc5ccccc45)Nc3sc2C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0011 |
| logD: | 6.9999 |
| logSw: | -6.8832 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.657 |
| InChI Key: | MAUQNSMCKBWZMM-UHFFFAOYSA-N |