2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-N-phenylacetamide
2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | 8007-8625 |
| Compound Name: | 2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 332.38 |
| Molecular Formula: | C16 H16 N2 O4 S |
| Smiles: | COc1ccc(CSCC(Nc2ccccc2)=O)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1843 |
| logD: | 3.1842 |
| logSw: | -3.649 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.827 |
| InChI Key: | XXKITQMPMORORL-UHFFFAOYSA-N |