methyl 2-methyl-5-[(3-nitrobenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-[(3-nitrobenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
methyl 2-methyl-5-[(3-nitrobenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 2318-0511 |
| Compound Name: | methyl 2-methyl-5-[(3-nitrobenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 390.37 |
| Molecular Formula: | C17 H14 N2 O7 S |
| Smiles: | Cc1c(C(=O)OC)c2cc(ccc2o1)NS(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2402 |
| logD: | 2.7668 |
| logSw: | -3.7735 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.391 |
| InChI Key: | KGJRQSSXMTYFQR-UHFFFAOYSA-N |