3-(2,5-dimethoxyphenyl)-6-(2-methoxyphenyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(2,5-dimethoxyphenyl)-6-(2-methoxyphenyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2,5-dimethoxyphenyl)-6-(2-methoxyphenyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | A0019209 |
| Compound Name: | 3-(2,5-dimethoxyphenyl)-6-(2-methoxyphenyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 577.7 |
| Molecular Formula: | C28 H23 N3 O5 S3 |
| Smiles: | COc1ccc(c(c1)N1C2=C(C(N(C(=N2)SCC(c2ccccc2)=O)c2ccccc2OC)=O)SC1=S)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9817 |
| logD: | 4.9817 |
| logSw: | -4.6951 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 62.404 |
| InChI Key: | CPZXDUPNBAZCJU-UHFFFAOYSA-N |