2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3,5-diphenylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3,5-diphenylthieno[2,3-d]pyrimidin-4(3H)-one
2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3,5-diphenylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4112-4040 |
| Compound Name: | 2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3,5-diphenylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 514.62 |
| Molecular Formula: | C28 H22 N2 O4 S2 |
| Smiles: | COc1ccc(cc1OC)C(CSC1=Nc2c(C(N1c1ccccc1)=O)c(cs2)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3094 |
| logD: | 5.3093 |
| logSw: | -5.4815 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.298 |
| InChI Key: | BVTPQGXPYCOAAS-UHFFFAOYSA-N |