dimethyl 2-{[(4-fluorophenyl)methyl]amino}-5-nitrobenzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[(4-fluorophenyl)methyl]amino}-5-nitrobenzene-1,3-dicarboxylate
dimethyl 2-{[(4-fluorophenyl)methyl]amino}-5-nitrobenzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C790-0619 |
| Compound Name: | dimethyl 2-{[(4-fluorophenyl)methyl]amino}-5-nitrobenzene-1,3-dicarboxylate |
| Molecular Weight: | 362.31 |
| Molecular Formula: | C17 H15 F N2 O6 |
| Smiles: | COC(c1cc(cc(C(=O)OC)c1NCc1ccc(cc1)F)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5863 |
| logD: | 2.5692 |
| logSw: | -2.9944 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.807 |
| InChI Key: | JBZHFPAAMRRAGN-UHFFFAOYSA-N |