3-[(azepan-1-yl)methyl]-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Chemical Structure Depiction of
3-[(azepan-1-yl)methyl]-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
3-[(azepan-1-yl)methyl]-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Compound characteristics
| Compound ID: | 8001-6821 |
| Compound Name: | 3-[(azepan-1-yl)methyl]-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione |
| Molecular Weight: | 376.47 |
| Molecular Formula: | C19 H24 N2 O4 S |
| Smiles: | COc1ccc(\C=C2/C(N(CN3CCCCCC3)C(=O)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5352 |
| logD: | 2.6886 |
| logSw: | -3.6479 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.614 |
| InChI Key: | MRZHIVXEOWCCAH-UHFFFAOYSA-N |