{[6-(2,4-dimethoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetonitrile
Chemical Structure Depiction of
{[6-(2,4-dimethoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetonitrile
{[6-(2,4-dimethoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetonitrile
Compound characteristics
| Compound ID: | K286-0341 |
| Compound Name: | {[6-(2,4-dimethoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetonitrile |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C21 H16 N4 O3 S3 |
| Smiles: | COc1ccc(c(c1)OC)N1C(=NC2=C(C1=O)SC(N2c1ccccc1)=S)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 3.4596 |
| logD: | 3.4596 |
| logSw: | -3.9672 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 59.591 |
| InChI Key: | GZNBVZMRGPNHFM-UHFFFAOYSA-N |