5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0295 |
| Compound Name: | 5-{[(1,3-dioxolan-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 513.66 |
| Molecular Formula: | C24 H23 N3 O4 S3 |
| Smiles: | COc1ccccc1N1C(=NC2=C(C1=O)SC(N2CCc1ccccc1)=S)SCC1OCCO1 |
| Stereo: | ACHIRAL |
| logP: | 3.9627 |
| logD: | 3.9627 |
| logSw: | -4.1014 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 52.412 |
| InChI Key: | BJLZNSGVHTTZBW-UHFFFAOYSA-N |