4-(4-tert-butylpyridin-1-ium-1-yl)-5-{[2-(2-hydroxybenzoyl)hydrazinylidene]methyl}-2-oxo-2H-1,3-thiazol-3-ide
Chemical Structure Depiction of
4-(4-tert-butylpyridin-1-ium-1-yl)-5-{[2-(2-hydroxybenzoyl)hydrazinylidene]methyl}-2-oxo-2H-1,3-thiazol-3-ide
4-(4-tert-butylpyridin-1-ium-1-yl)-5-{[2-(2-hydroxybenzoyl)hydrazinylidene]methyl}-2-oxo-2H-1,3-thiazol-3-ide
Compound characteristics
| Compound ID: | 3347-7320 |
| Compound Name: | 4-(4-tert-butylpyridin-1-ium-1-yl)-5-{[2-(2-hydroxybenzoyl)hydrazinylidene]methyl}-2-oxo-2H-1,3-thiazol-3-ide |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | CC(C)(C)c1cc[n+](cc1)C1=C(/C=N/NC(c2ccccc2O)=O)SC([N-]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7345 |
| logD: | 4.3118 |
| logSw: | -3.95 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.313 |
| InChI Key: | SEPPMLHXMHBHEB-UHFFFAOYSA-N |