pentyl 5-[(4-methoxy-3-nitrobenzene-1-sulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
pentyl 5-[(4-methoxy-3-nitrobenzene-1-sulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
pentyl 5-[(4-methoxy-3-nitrobenzene-1-sulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 6145-1059 |
| Compound Name: | pentyl 5-[(4-methoxy-3-nitrobenzene-1-sulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 476.5 |
| Molecular Formula: | C22 H24 N2 O8 S |
| Smiles: | CCCCCOC(c1c2cc(ccc2oc1C)NS(c1ccc(c(c1)[N+]([O-])=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0179 |
| logD: | 4.9405 |
| logSw: | -4.8798 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.594 |
| InChI Key: | CQFSDAMAKJTNJC-UHFFFAOYSA-N |