3-methyl-5-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-5-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-methyl-5-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3584-0927 |
| Compound Name: | 3-methyl-5-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C22 H20 N2 O5 S2 |
| Smiles: | CN1C(/C(=C\c2cc(ccc2OCCOc2ccccc2CC=C)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2151 |
| logD: | 5.2151 |
| logSw: | -5.1033 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.598 |
| InChI Key: | LYBYTSCDIXSPJA-UHFFFAOYSA-N |