2-[(3-ethyl-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(3-ethyl-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
2-[(3-ethyl-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Compound characteristics
Compound ID: | K286-3818 |
Compound Name: | 2-[(3-ethyl-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide |
Molecular Weight: | 484.62 |
Molecular Formula: | C22 H20 N4 O3 S3 |
Smiles: | CCN1C2=C(C(N(C(=N2)SCC(Nc2cccc(c2)OC)=O)c2ccccc2)=O)SC1=S |
Stereo: | ACHIRAL |
logP: | 4.0261 |
logD: | 4.0261 |
logSw: | -4.1397 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.255 |
InChI Key: | UCSUIPGRGIUCIS-UHFFFAOYSA-N |