2-cyano-1-(4-methylbenzamido)-2-(triphenylphosphaniumyl)ethene-1-thiolate
Chemical Structure Depiction of
2-cyano-1-(4-methylbenzamido)-2-(triphenylphosphaniumyl)ethene-1-thiolate
2-cyano-1-(4-methylbenzamido)-2-(triphenylphosphaniumyl)ethene-1-thiolate
Compound characteristics
| Compound ID: | 8005-3543 |
| Compound Name: | 2-cyano-1-(4-methylbenzamido)-2-(triphenylphosphaniumyl)ethene-1-thiolate |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C29 H23 N2 O P S |
| Smiles: | Cc1ccc(cc1)C(N/C(=C(\C#N)[P+](c1ccccc1)(c1ccccc1)c1ccccc1)[S-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.8107 |
| logD: | 6.8099 |
| logSw: | -5.8749 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.715 |
| InChI Key: | HWDMJKTYUWACFL-UHFFFAOYSA-N |