5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-fluorobenzamido)benzoic acid
Chemical Structure Depiction of
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-fluorobenzamido)benzoic acid
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-fluorobenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0232 |
| Compound Name: | 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-fluorobenzamido)benzoic acid |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C26 H26 F N3 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.275 |
| logD: | 1.1588 |
| logSw: | -5.0288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.452 |
| InChI Key: | SMIOADSNLNNHBR-UHFFFAOYSA-N |