3-(4-methoxybenzamido)-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-(4-methoxybenzamido)-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
3-(4-methoxybenzamido)-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F086-0584 |
| Compound Name: | 3-(4-methoxybenzamido)-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.5 |
| Molecular Formula: | C24 H24 N4 O4 |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)C(Nc1cc(ccc1N1CCN(CC1)c1ccccn1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5048 |
| logD: | 2.6104 |
| logSw: | -4.1625 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.507 |
| InChI Key: | ZZLPBAKAAZIOJS-UHFFFAOYSA-N |