4-[(benzylimino)methyl]-2,6-dibromophenyl 5-nitrofuran-2-carboxylate
Chemical Structure Depiction of
4-[(benzylimino)methyl]-2,6-dibromophenyl 5-nitrofuran-2-carboxylate
4-[(benzylimino)methyl]-2,6-dibromophenyl 5-nitrofuran-2-carboxylate
Compound characteristics
| Compound ID: | 8004-5166 |
| Compound Name: | 4-[(benzylimino)methyl]-2,6-dibromophenyl 5-nitrofuran-2-carboxylate |
| Molecular Weight: | 508.12 |
| Molecular Formula: | C19 H12 Br2 N2 O5 |
| Smiles: | C(c1ccccc1)/N=C/c1cc(c(c(c1)[Br])OC(c1ccc([N+]([O-])=O)o1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0537 |
| logD: | 5.0536 |
| logSw: | -5.0738 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.112 |
| InChI Key: | PIFSFTVOHSNOOM-UHFFFAOYSA-N |