4-(isoquinolin-2-ium-2-yl)-2-oxo-5-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}-2H-1,3-thiazol-3-ide
Chemical Structure Depiction of
4-(isoquinolin-2-ium-2-yl)-2-oxo-5-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}-2H-1,3-thiazol-3-ide
4-(isoquinolin-2-ium-2-yl)-2-oxo-5-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}-2H-1,3-thiazol-3-ide
Compound characteristics
| Compound ID: | 5577-0019 |
| Compound Name: | 4-(isoquinolin-2-ium-2-yl)-2-oxo-5-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}-2H-1,3-thiazol-3-ide |
| Molecular Weight: | 375.41 |
| Molecular Formula: | C19 H13 N5 O2 S |
| Smiles: | C(\C1=C([N-]C(=O)S1)[n+]1ccc2ccccc2c1)=N/NC(c1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6312 |
| logD: | 2.2191 |
| logSw: | -2.8954 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.814 |
| InChI Key: | VGAYLUPOYYKOKX-UHFFFAOYSA-N |