3-(3,4-dimethylphenyl)-6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(3,4-dimethylphenyl)-6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
Compound ID: | K286-3399 |
Compound Name: | 3-(3,4-dimethylphenyl)-6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
Molecular Weight: | 441.59 |
Molecular Formula: | C21 H19 N3 O2 S3 |
Smiles: | Cc1ccc(cc1C)N1C2=C(C(N(C(=N2)SC)c2ccccc2OC)=O)SC1=S |
Stereo: | ACHIRAL |
logP: | 4.9739 |
logD: | 4.9739 |
logSw: | -4.6631 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 34.556 |
InChI Key: | GWGLSVFBSBIRLO-UHFFFAOYSA-N |