2-(4-chlorobenzamido)-5-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)benzoic acid
Chemical Structure Depiction of
2-(4-chlorobenzamido)-5-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)benzoic acid
2-(4-chlorobenzamido)-5-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F687-0160 |
| Compound Name: | 2-(4-chlorobenzamido)-5-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)benzoic acid |
| Molecular Weight: | 458.94 |
| Molecular Formula: | C23 H27 Cl N4 O4 |
| Smiles: | CC(C)NC(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1688 |
| logD: | -0.9474 |
| logSw: | -3.5673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.75 |
| InChI Key: | VRYAWTJLKHVOPD-UHFFFAOYSA-N |