5-({2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-({2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-({2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3584-0980 |
| Compound Name: | 5-({2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 458.55 |
| Molecular Formula: | C22 H22 N2 O5 S2 |
| Smiles: | CCc1cc(C)cc(c1)OCCOc1ccc(cc1\C=C1/C(N(C)C(=S)S1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7954 |
| logD: | 5.7954 |
| logSw: | -5.4151 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.512 |
| InChI Key: | AUHIJTPNSCHMRX-UHFFFAOYSA-N |