5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methylbenzamido)benzoic acid
Chemical Structure Depiction of
5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methylbenzamido)benzoic acid
5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methylbenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0073 |
| Compound Name: | 5-{4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-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(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7067 |
| logD: | -1.4095 |
| logSw: | -2.9745 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.709 |
| InChI Key: | YNHDQPPYAURULB-UHFFFAOYSA-N |