5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(3-methylbenzamido)benzoic acid
Chemical Structure Depiction of
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(3-methylbenzamido)benzoic acid
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(3-methylbenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0324 |
| Compound Name: | 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(3-methylbenzamido)benzoic acid |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(cc1C(O)=O)N1CCN(CC1)c1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6631 |
| logD: | 1.5469 |
| logSw: | -5.2566 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.452 |
| InChI Key: | VUQFHTLILJGUAQ-UHFFFAOYSA-N |