5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(3-methylbenzamido)benzoic acid
Chemical Structure Depiction of
5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(3-methylbenzamido)benzoic acid
5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(3-methylbenzamido)benzoic acid
Compound characteristics
Compound ID: | F687-0349 |
Compound Name: | 5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(3-methylbenzamido)benzoic acid |
Molecular Weight: | 452.55 |
Molecular Formula: | C25 H32 N4 O4 |
Smiles: | CCN(CC)C(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1cccc(C)c1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6544 |
logD: | -1.4619 |
logSw: | -2.9549 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.709 |
InChI Key: | QZPBLJWSWAYVGI-UHFFFAOYSA-N |