ethyl 5-[(4,5-dicyano-2-nitroanilino)methyl]furan-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[(4,5-dicyano-2-nitroanilino)methyl]furan-2-carboxylate
ethyl 5-[(4,5-dicyano-2-nitroanilino)methyl]furan-2-carboxylate
Compound characteristics
| Compound ID: | 8016-3866 |
| Compound Name: | ethyl 5-[(4,5-dicyano-2-nitroanilino)methyl]furan-2-carboxylate |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C16 H12 N4 O5 |
| Smiles: | CCOC(c1ccc(CNc2cc(C#N)c(C#N)cc2[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0085 |
| logD: | 3.0085 |
| logSw: | -3.5401 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.563 |
| InChI Key: | ZCCDOSJUYHWKTM-UHFFFAOYSA-N |