2-[benzyl(ethyl)amino]-5-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[benzyl(ethyl)amino]-5-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
2-[benzyl(ethyl)amino]-5-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0019 |
| Compound Name: | 2-[benzyl(ethyl)amino]-5-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 506.45 |
| Molecular Formula: | C23 H21 F N2 O3 |
| Salt: | CF3COOH |
| Smiles: | CCN(Cc1ccccc1)c1ccc(cc1C(O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5719 |
| logD: | 2.6057 |
| logSw: | -4.2607 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.177 |
| InChI Key: | ILUQBKCCZDBKDC-UHFFFAOYSA-N |