5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3973 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 552.14 |
| Molecular Formula: | C27 H22 Cl N3 O2 S3 |
| Smiles: | CCOc1ccc(cc1)N1C2=C(C(N(C(=N2)SCc2ccccc2[Cl])c2ccc(C)cc2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 6.9608 |
| logD: | 6.9608 |
| logSw: | -6.2609 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 34.078 |
| InChI Key: | OGEOLAGSCYQJGP-UHFFFAOYSA-N |