3-(2-methylbenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
3-(2-methylbenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
3-(2-methylbenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Compound characteristics
Compound ID: | F086-0274 |
Compound Name: | 3-(2-methylbenzamido)-4-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid |
Molecular Weight: | 552.55 |
Molecular Formula: | C24 H30 N4 O4 |
Salt: | CF3COOH |
Smiles: | CCCNC(CN1CCN(CC1)c1ccc(cc1NC(c1ccccc1C)=O)C(O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4614 |
logD: | 1.567 |
logSw: | -3.5874 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 82.316 |
InChI Key: | ODFFVGNCQFUZST-UHFFFAOYSA-N |