3-(2,4-dimethylphenyl)-6-(2-methylphenyl)-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-(2-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2,4-dimethylphenyl)-6-(2-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3389 |
| Compound Name: | 3-(2,4-dimethylphenyl)-6-(2-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 425.59 |
| Molecular Formula: | C21 H19 N3 O S3 |
| Smiles: | Cc1ccc(c(C)c1)N1C2=C(C(N(C(=N2)SC)c2ccccc2C)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.5535 |
| logD: | 5.5535 |
| logSw: | -5.4175 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 26.6242 |
| InChI Key: | RKNCFDHHSCQVAV-UHFFFAOYSA-N |