2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 2969-0388 |
| Compound Name: | 2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 432.61 |
| Molecular Formula: | C25 H24 N2 O S2 |
| Smiles: | Cc1ccc(CSC2=Nc3c(C(N2c2ccccc2)=O)c2CCCCc2s3)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.5916 |
| logD: | 6.5916 |
| logSw: | -5.581 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.9824 |
| InChI Key: | CIUACRJKXRIWAA-UHFFFAOYSA-N |