3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,5-bis(sulfanylidene)-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,5-bis(sulfanylidene)-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,5-bis(sulfanylidene)-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | K286-3315 |
| Compound Name: | 3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,5-bis(sulfanylidene)-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one |
| Molecular Weight: | 542.78 |
| Molecular Formula: | C21 H19 N3 O2 S3 |
| Salt: | (C2H5)3N |
| Smiles: | CCOc1ccc(cc1)N1C(C2=C(NC1=S)N(C(=S)S2)c1ccc(C)c(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0535 |
| logD: | 5.0535 |
| logSw: | -4.5917 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.625 |
| InChI Key: | UPZYWNKGFOAHAC-UHFFFAOYSA-N |