3-(2,5-dimethoxyphenyl)-5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(2,5-dimethoxyphenyl)-5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2,5-dimethoxyphenyl)-5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3324 |
| Compound Name: | 3-(2,5-dimethoxyphenyl)-5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 529.66 |
| Molecular Formula: | C24 H23 N3 O5 S3 |
| Smiles: | Cc1ccccc1N1C(=NC2=C(C1=O)SC(N2c1cc(ccc1OC)OC)=S)SCC1OCCO1 |
| Stereo: | ACHIRAL |
| logP: | 4.1493 |
| logD: | 4.1493 |
| logSw: | -4.3431 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 59.065 |
| InChI Key: | ZFXRAYNBPWNNPW-UHFFFAOYSA-N |