5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-(2-methylbenzamido)benzoic acid
Chemical Structure Depiction of
5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-(2-methylbenzamido)benzoic acid
5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-(2-methylbenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0306 |
| Compound Name: | 5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-(2-methylbenzamido)benzoic acid |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C23 H28 N4 O4 |
| Smiles: | Cc1ccccc1C(Nc1ccc(cc1C(O)=O)N1CCN(CC1)CC(N(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4691 |
| logD: | -2.6471 |
| logSw: | -2.4689 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.778 |
| InChI Key: | SFIXFOVKDYGHCR-UHFFFAOYSA-N |