5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2,2-dimethylpropanamido)benzoic acid
Chemical Structure Depiction of
5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2,2-dimethylpropanamido)benzoic acid
5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2,2-dimethylpropanamido)benzoic acid
Compound characteristics
| Compound ID: | SR00-0009 |
| Compound Name: | 5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2,2-dimethylpropanamido)benzoic acid |
| Molecular Weight: | 429.95 |
| Molecular Formula: | C23 H28 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(C(C)(C)C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.042 |
| logD: | 1.339 |
| logSw: | -4.781 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.72 |
| InChI Key: | CIZFJWNPMDYMBK-UHFFFAOYSA-N |