2-(benzylsulfanyl)-N-(4-methoxyphenyl)-4-nitrobenzamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-N-(4-methoxyphenyl)-4-nitrobenzamide
2-(benzylsulfanyl)-N-(4-methoxyphenyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8012-5531 |
| Compound Name: | 2-(benzylsulfanyl)-N-(4-methoxyphenyl)-4-nitrobenzamide |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C21 H18 N2 O4 S |
| Smiles: | COc1ccc(cc1)NC(c1ccc(cc1SCc1ccccc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7001 |
| logD: | 4.6999 |
| logSw: | -4.5161 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.983 |
| InChI Key: | QUCWARIMEUWAEJ-UHFFFAOYSA-N |