3-(2,4-dimethoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-thiazolidin-4-one
3-(2,4-dimethoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | K205-1764 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-thiazolidin-4-one |
| Molecular Weight: | 404.4 |
| Molecular Formula: | C18 H16 N2 O7 S |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2cc3c(cc2[N+]([O-])=O)OCO3)SCC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0502 |
| logD: | 3.0502 |
| logSw: | -3.5407 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.202 |
| InChI Key: | ZQKVPSSWWQRBOF-SFHVURJKSA-N |