N-[2,2,2-trichloro-1-(4-nitroanilino)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[2,2,2-trichloro-1-(4-nitroanilino)ethyl]furan-2-carboxamide
N-[2,2,2-trichloro-1-(4-nitroanilino)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | 1501-1178 |
| Compound Name: | N-[2,2,2-trichloro-1-(4-nitroanilino)ethyl]furan-2-carboxamide |
| Molecular Weight: | 378.6 |
| Molecular Formula: | C13 H10 Cl3 N3 O4 |
| Smiles: | c1cc(C(NC(C([Cl])([Cl])[Cl])Nc2ccc(cc2)[N+]([O-])=O)=O)oc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3775 |
| logD: | 3.2773 |
| logSw: | -3.7274 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.41 |
| InChI Key: | RKQYUYVPMSNUSU-GFCCVEGCSA-N |