methyl 5-[N-(4-chloro-3-nitrobenzene-1-sulfonyl)-4-methylbenzamido]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-[N-(4-chloro-3-nitrobenzene-1-sulfonyl)-4-methylbenzamido]-2-methyl-1-benzofuran-3-carboxylate
methyl 5-[N-(4-chloro-3-nitrobenzene-1-sulfonyl)-4-methylbenzamido]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 2318-0299 |
| Compound Name: | methyl 5-[N-(4-chloro-3-nitrobenzene-1-sulfonyl)-4-methylbenzamido]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 542.95 |
| Molecular Formula: | C25 H19 Cl N2 O8 S |
| Smiles: | Cc1ccc(cc1)C(N(c1ccc2c(c1)c(C(=O)OC)c(C)o2)S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3355 |
| logD: | 5.3355 |
| logSw: | -6.3756 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 107.748 |
| InChI Key: | JPCFOHGCDBDKJL-UHFFFAOYSA-N |