2-butanamido-5-(4-cyclohexylpiperazin-1-yl)benzoic acid
Chemical Structure Depiction of
2-butanamido-5-(4-cyclohexylpiperazin-1-yl)benzoic acid
2-butanamido-5-(4-cyclohexylpiperazin-1-yl)benzoic acid
Compound characteristics
Compound ID: | F687-0088 |
Compound Name: | 2-butanamido-5-(4-cyclohexylpiperazin-1-yl)benzoic acid |
Molecular Weight: | 373.49 |
Molecular Formula: | C21 H31 N3 O3 |
Smiles: | CCCC(Nc1ccc(cc1C(O)=O)N1CCN(CC1)C1CCCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.3473 |
logD: | 3.3473 |
logSw: | -3.5089 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.644 |
InChI Key: | XFOSEAYMKGMBPY-UHFFFAOYSA-N |