N-{3-(4-chloro-3-nitroanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{3-(4-chloro-3-nitroanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-2-fluorobenzamide
N-{3-(4-chloro-3-nitroanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | 2447-2549 |
| Compound Name: | N-{3-(4-chloro-3-nitroanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-2-fluorobenzamide |
| Molecular Weight: | 482.9 |
| Molecular Formula: | C24 H20 Cl F N4 O4 |
| Smiles: | CN(C)c1ccc(/C=C(/C(Nc2ccc(c(c2)[N+]([O-])=O)[Cl])=O)NC(c2ccccc2F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6229 |
| logD: | 3.0904 |
| logSw: | -4.8733 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.14 |
| InChI Key: | WISQVNLJXVJXRH-UHFFFAOYSA-N |