2-(4-methoxyphenyl)-2-oxo-1-phenylethyl 2-[(2,4-dinitrophenyl)sulfanyl]benzoate
Chemical Structure Depiction of
2-(4-methoxyphenyl)-2-oxo-1-phenylethyl 2-[(2,4-dinitrophenyl)sulfanyl]benzoate
2-(4-methoxyphenyl)-2-oxo-1-phenylethyl 2-[(2,4-dinitrophenyl)sulfanyl]benzoate
Compound characteristics
| Compound ID: | 2477-0791 |
| Compound Name: | 2-(4-methoxyphenyl)-2-oxo-1-phenylethyl 2-[(2,4-dinitrophenyl)sulfanyl]benzoate |
| Molecular Weight: | 544.54 |
| Molecular Formula: | C28 H20 N2 O8 S |
| Smiles: | COc1ccc(cc1)C(C(c1ccccc1)OC(c1ccccc1Sc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8841 |
| logD: | 6.8841 |
| logSw: | -5.6696 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 107.574 |
| InChI Key: | UXPRFHAXGYGHNE-HHHXNRCGSA-N |