2-(2,4-dichlorophenyl)-6-(methylsulfanyl)-4-oxo-5-(triphenylphosphaniumyl)-4H-pyrimidin-3-ide
Chemical Structure Depiction of
2-(2,4-dichlorophenyl)-6-(methylsulfanyl)-4-oxo-5-(triphenylphosphaniumyl)-4H-pyrimidin-3-ide
2-(2,4-dichlorophenyl)-6-(methylsulfanyl)-4-oxo-5-(triphenylphosphaniumyl)-4H-pyrimidin-3-ide
Compound characteristics
| Compound ID: | 8007-5924 |
| Compound Name: | 2-(2,4-dichlorophenyl)-6-(methylsulfanyl)-4-oxo-5-(triphenylphosphaniumyl)-4H-pyrimidin-3-ide |
| Molecular Weight: | 547.44 |
| Molecular Formula: | C29 H21 Cl2 N2 O P S |
| Smiles: | CSC1=C(C([N-]C(c2ccc(cc2[Cl])[Cl])=N1)=O)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 8.0021 |
| logD: | 8.0021 |
| logSw: | -6.5862 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.42 |
| InChI Key: | UISQCNGJMKKCNQ-UHFFFAOYSA-N |