2-(2-oxo-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}ethyl)benzoic acid
Chemical Structure Depiction of
2-(2-oxo-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}ethyl)benzoic acid
2-(2-oxo-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}ethyl)benzoic acid
Compound characteristics
| Compound ID: | IB06-1571 |
| Compound Name: | 2-(2-oxo-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}ethyl)benzoic acid |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C19 H25 N3 O4 |
| Smiles: | C1CCN(C1)C(CN1CCN(CC1)C(Cc1ccccc1C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.81 |
| logD: | -2.45 |
| logSw: | -1.81 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 124.2 |
| InChI Key: | VJWRZQDSZFXBGR-UHFFFAOYSA-N |