5-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}-2-(4-fluorobenzamido)benzoic acid
Chemical Structure Depiction of
5-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}-2-(4-fluorobenzamido)benzoic acid
5-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}-2-(4-fluorobenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0212 |
| Compound Name: | 5-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}-2-(4-fluorobenzamido)benzoic acid |
| Molecular Weight: | 494.5 |
| Molecular Formula: | C26 H24 F2 N4 O4 |
| Smiles: | C1CN(CCN1CC(Nc1ccc(cc1)F)=O)c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9695 |
| logD: | -0.1467 |
| logSw: | -4.1294 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.182 |
| InChI Key: | IYMMVDUHNOTQIG-UHFFFAOYSA-N |