5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3979 |
| Compound Name: | 5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 589.75 |
| Molecular Formula: | C30 H27 N3 O4 S3 |
| Smiles: | CCOc1ccc(cc1)N1C2=C(C(N(C(=N2)SCc2cc(ccc2OC)C(C)=O)c2ccc(C)cc2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.9824 |
| logD: | 5.9824 |
| logSw: | -5.4619 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 55.535 |
| InChI Key: | UJXCRYCISBSCHQ-UHFFFAOYSA-N |