3-methyl-2-(methylimino)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-2-(methylimino)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one
3-methyl-2-(methylimino)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8009-7165 |
| Compound Name: | 3-methyl-2-(methylimino)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one |
| Molecular Weight: | 321.31 |
| Molecular Formula: | C13 H11 N3 O5 S |
| Smiles: | C/N=C1\N(C)C(/C(=C\c2cc3c(cc2[N+]([O-])=O)OCO3)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.054 |
| logD: | 2.054 |
| logSw: | -2.5079 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.122 |
| InChI Key: | VISXSUREQUFGII-UHFFFAOYSA-N |