ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propyl-1-benzofuran-3-carboxylate
ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 4456-0339 |
| Compound Name: | ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 466.9 |
| Molecular Formula: | C20 H19 Cl N2 O7 S |
| Smiles: | CCCc1c(C(=O)OCC)c2cc(ccc2o1)NS(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1406 |
| logD: | 4.3485 |
| logSw: | -5.9467 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.419 |
| InChI Key: | ZLKGTDAQXQXEBO-UHFFFAOYSA-N |