7-tert-butyl-2-(methylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-2-(methylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-2-(methylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4819-0505 |
| Compound Name: | 7-tert-butyl-2-(methylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 384.56 |
| Molecular Formula: | C21 H24 N2 O S2 |
| Smiles: | CC(C)(C)C1CCc2c3C(N(C(=Nc3sc2C1)SC)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5325 |
| logD: | 5.5325 |
| logSw: | -5.5114 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.254 |
| InChI Key: | DTJDOZYHVJWHNN-CYBMUJFWSA-N |