methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-methylnaphtho[1,2-b]furan-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-methylnaphtho[1,2-b]furan-3-carboxylate
methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-methylnaphtho[1,2-b]furan-3-carboxylate
Compound characteristics
| Compound ID: | 4456-3507 |
| Compound Name: | methyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-methylnaphtho[1,2-b]furan-3-carboxylate |
| Molecular Weight: | 474.87 |
| Molecular Formula: | C21 H15 Cl N2 O7 S |
| Smiles: | Cc1c(C(=O)OC)c2cc(c3ccccc3c2o1)NS(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6781 |
| logD: | 4.3338 |
| logSw: | -5.1943 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.354 |
| InChI Key: | WXJFUSCOPXOLKU-UHFFFAOYSA-N |