2,2'-[(7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyl)bis(sulfanediyl)]bis(1-phenylethan-1-one)
Chemical Structure Depiction of
2,2'-[(7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyl)bis(sulfanediyl)]bis(1-phenylethan-1-one)
2,2'-[(7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyl)bis(sulfanediyl)]bis(1-phenylethan-1-one)
Compound characteristics
| Compound ID: | 4333-3571 |
| Compound Name: | 2,2'-[(7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyl)bis(sulfanediyl)]bis(1-phenylethan-1-one) |
| Molecular Weight: | 546.77 |
| Molecular Formula: | C30 H30 N2 O2 S3 |
| Smiles: | CC(C)(C)C1CCc2c3c(nc(nc3sc2C1)SCC(c1ccccc1)=O)SCC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.0837 |
| logD: | 8.0837 |
| logSw: | -6.113 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.639 |
| InChI Key: | VWFPJUIUBKMJJB-OAQYLSRUSA-N |