3-(2-chlorobenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
3-(2-chlorobenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
3-(2-chlorobenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | F086-0030 |
| Compound Name: | 3-(2-chlorobenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid |
| Molecular Weight: | 458.94 |
| Molecular Formula: | C23 H27 Cl N4 O4 |
| Smiles: | CCCNC(CN1CCN(CC1)c1ccc(cc1NC(c1ccccc1[Cl])=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6976 |
| logD: | 1.8032 |
| logSw: | -3.9025 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.316 |
| InChI Key: | DGVHGPGMGVSUMW-UHFFFAOYSA-N |