ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propylnaphtho[1,2-b]furan-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propylnaphtho[1,2-b]furan-3-carboxylate
ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propylnaphtho[1,2-b]furan-3-carboxylate
Compound characteristics
| Compound ID: | 4456-0443 |
| Compound Name: | ethyl 5-[(4-chloro-3-nitrobenzene-1-sulfonyl)amino]-2-propylnaphtho[1,2-b]furan-3-carboxylate |
| Molecular Weight: | 516.96 |
| Molecular Formula: | C24 H21 Cl N2 O7 S |
| Smiles: | CCCc1c(C(=O)OCC)c2cc(c3ccccc3c2o1)NS(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0229 |
| logD: | 5.6786 |
| logSw: | -6.2316 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.682 |
| InChI Key: | PSIMCCXYHNUUHK-UHFFFAOYSA-N |