5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(3,4-dimethylphenyl)-6-phenyl-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-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
Compound ID: | K286-4165 |
Compound Name: | 5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
Molecular Weight: | 559.73 |
Molecular Formula: | C29 H25 N3 O3 S3 |
Smiles: | CC(c1ccc(c(CSC2=NC3=C(C(N2c2ccccc2)=O)SC(N3c2ccc(C)c(C)c2)=S)c1)OC)=O |
Stereo: | ACHIRAL |
logP: | 6.201 |
logD: | 6.201 |
logSw: | -5.4923 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 48.412 |
InChI Key: | WABOEGBNBQQORK-UHFFFAOYSA-N |