ethyl 4-[4-(3-fluoro-4-methylanilino)-3,5-dinitrobenzamido]benzoate
Chemical Structure Depiction of
ethyl 4-[4-(3-fluoro-4-methylanilino)-3,5-dinitrobenzamido]benzoate
ethyl 4-[4-(3-fluoro-4-methylanilino)-3,5-dinitrobenzamido]benzoate
Compound characteristics
| Compound ID: | 8008-4558 |
| Compound Name: | ethyl 4-[4-(3-fluoro-4-methylanilino)-3,5-dinitrobenzamido]benzoate |
| Molecular Weight: | 482.42 |
| Molecular Formula: | C23 H19 F N4 O7 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc(c(c(c1)[N+]([O-])=O)Nc1ccc(C)c(c1)F)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5639 |
| logD: | 5.05 |
| logSw: | -5.3922 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.761 |
| InChI Key: | KQEBFSSWWIEGFA-UHFFFAOYSA-N |