5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3584-0981 |
| Compound Name: | 5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 458.55 |
| Molecular Formula: | C22 H22 N2 O5 S2 |
| Smiles: | CCN1C(/C(=C\c2cc(ccc2OCCOc2ccc(C)c(C)c2)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.934 |
| logD: | 5.934 |
| logSw: | -5.4335 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.471 |
| InChI Key: | PGKZYWFELDFXGV-UHFFFAOYSA-N |