S-{4-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl} ethanethioate
Chemical Structure Depiction of
S-{4-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl} ethanethioate
S-{4-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl} ethanethioate
Compound characteristics
| Compound ID: | 8012-6830 |
| Compound Name: | S-{4-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl} ethanethioate |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C16 H13 N3 O4 S |
| Smiles: | CC(=O)SC1NC(/C(=C/c2cc3cc(ccc3nc2O)OC)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0044 |
| logD: | 1.4869 |
| logSw: | -2.9076 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.158 |
| InChI Key: | QAVKFEAUBSZMJD-UHFFFAOYSA-N |