N~1~-{2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
Chemical Structure Depiction of
N~1~-{2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
N~1~-{2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
Compound characteristics
Compound ID: | 8008-9541 |
Compound Name: | N~1~-{2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide |
Molecular Weight: | 454.54 |
Molecular Formula: | C25 H31 F N4 O3 |
Smiles: | CC(C)(C)c1ccc(cc1)C(N1CCN(CCNC(C(Nc2ccc(cc2)F)=O)=O)CC1)=O |
Stereo: | ACHIRAL |
logP: | 2.9671 |
logD: | 1.7614 |
logSw: | -3.3314 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.295 |
InChI Key: | SXBHEOYJSQYSPX-UHFFFAOYSA-N |