4-[(2-chlorophenyl)sulfanyl]-N-(3-methoxyphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)sulfanyl]-N-(3-methoxyphenyl)-3-nitrobenzamide
4-[(2-chlorophenyl)sulfanyl]-N-(3-methoxyphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K784-1458 |
| Compound Name: | 4-[(2-chlorophenyl)sulfanyl]-N-(3-methoxyphenyl)-3-nitrobenzamide |
| Molecular Weight: | 414.87 |
| Molecular Formula: | C20 H15 Cl N2 O4 S |
| Smiles: | COc1cccc(c1)NC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7464 |
| logD: | 5.7397 |
| logSw: | -5.9817 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.682 |
| InChI Key: | NWYVOHMQKFCNQL-UHFFFAOYSA-N |