3-methyl-5-[(2-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-5-[(2-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-methyl-5-[(2-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3584-1242 |
| Compound Name: | 3-methyl-5-[(2-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 474.55 |
| Molecular Formula: | C22 H22 N2 O6 S2 |
| Smiles: | Cc1cccc(c1)OCCOCCOc1ccc(cc1\C=C1/C(N(C)C(=S)S1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5805 |
| logD: | 4.5805 |
| logSw: | -4.5733 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 72.783 |
| InChI Key: | OQAKBYRIGQSOHM-UHFFFAOYSA-N |