[4-(2-bromobenzoyl)piperazin-1-yl][3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]methanone
Chemical Structure Depiction of
[4-(2-bromobenzoyl)piperazin-1-yl][3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]methanone
[4-(2-bromobenzoyl)piperazin-1-yl][3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]methanone
Compound characteristics
Compound ID: | E687-0695 |
Compound Name: | [4-(2-bromobenzoyl)piperazin-1-yl][3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]methanone |
Molecular Weight: | 467.36 |
Molecular Formula: | C23 H23 Br N4 O2 |
Smiles: | Cc1ccc(c(C)c1)c1cc(C(N2CCN(CC2)C(c2ccccc2[Br])=O)=O)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 4.0299 |
logD: | 4.0295 |
logSw: | -4.102 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.833 |
InChI Key: | URKWAWQYKFWUPX-UHFFFAOYSA-N |