2-{2-[2-nitro-4-(3-nitrobenzene-1-sulfonyl)anilino]ethoxy}ethyl acetate
Chemical Structure Depiction of
2-{2-[2-nitro-4-(3-nitrobenzene-1-sulfonyl)anilino]ethoxy}ethyl acetate
2-{2-[2-nitro-4-(3-nitrobenzene-1-sulfonyl)anilino]ethoxy}ethyl acetate
Compound characteristics
| Compound ID: | 8007-2062 |
| Compound Name: | 2-{2-[2-nitro-4-(3-nitrobenzene-1-sulfonyl)anilino]ethoxy}ethyl acetate |
| Molecular Weight: | 453.43 |
| Molecular Formula: | C18 H19 N3 O9 S |
| Smiles: | CC(=O)OCCOCCNc1ccc(cc1[N+]([O-])=O)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6308 |
| logD: | 2.6308 |
| logSw: | -3.0824 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 135.272 |
| InChI Key: | NBJDGOOUVCQKQD-UHFFFAOYSA-N |