3-benzyl-2-{[(2,4-dimethylphenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(2,4-dimethylphenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-benzyl-2-{[(2,4-dimethylphenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0079 |
| Compound Name: | 3-benzyl-2-{[(2,4-dimethylphenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 392.54 |
| Molecular Formula: | C22 H20 N2 O S2 |
| Smiles: | Cc1ccc(CSC2=Nc3ccsc3C(N2Cc2ccccc2)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.0775 |
| logD: | 6.0775 |
| logSw: | -5.4111 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.7894 |
| InChI Key: | XMFVIYVDRHZSEI-UHFFFAOYSA-N |