5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3584-0778 |
| Compound Name: | 5-({2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C21 H20 N2 O5 S2 |
| Smiles: | Cc1ccc(cc1C)OCCOc1ccc(cc1\C=C1/C(N(C)C(=S)S1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3005 |
| logD: | 5.3005 |
| logSw: | -5.3066 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.512 |
| InChI Key: | SCJOJUMLUYTXGG-UHFFFAOYSA-N |