3-(2,4-dimethylphenyl)-6-(4-ethoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(2,4-dimethylphenyl)-6-(4-ethoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2,4-dimethylphenyl)-6-(4-ethoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3408 |
| Compound Name: | 3-(2,4-dimethylphenyl)-6-(4-ethoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C22 H21 N3 O2 S3 |
| Smiles: | CCOc1ccc(cc1)N1C(=NC2=C(C1=O)SC(N2c1ccc(C)cc1C)=S)SC |
| Stereo: | ACHIRAL |
| logP: | 5.4943 |
| logD: | 5.4943 |
| logSw: | -5.3755 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 34.049 |
| InChI Key: | CXXPDPHHKXBGJN-UHFFFAOYSA-N |