methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate
methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 8012-8374 |
| Compound Name: | methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate |
| Molecular Weight: | 454.84 |
| Molecular Formula: | C18 H15 Cl N2 O8 S |
| Smiles: | COCc1c(C(=O)OC)c2cc(ccc2o1)NS(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4162 |
| logD: | 2.6241 |
| logSw: | -4.2363 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.263 |
| InChI Key: | CSQTWOXVQMHCNV-UHFFFAOYSA-N |