N-[4-(4-bromophenyl)-3-methyl-1H-pyrazol-5-yl]-2-(2,5-dimethylphenoxy)acetamide
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-3-methyl-1H-pyrazol-5-yl]-2-(2,5-dimethylphenoxy)acetamide
N-[4-(4-bromophenyl)-3-methyl-1H-pyrazol-5-yl]-2-(2,5-dimethylphenoxy)acetamide
Compound characteristics
Compound ID: | Z296-1094 |
Compound Name: | N-[4-(4-bromophenyl)-3-methyl-1H-pyrazol-5-yl]-2-(2,5-dimethylphenoxy)acetamide |
Molecular Weight: | 414.3 |
Molecular Formula: | C20 H20 Br N3 O2 |
Smiles: | Cc1ccc(C)c(c1)OCC(Nc1c(c2ccc(cc2)[Br])c(C)n[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 4.9488 |
logD: | 4.9486 |
logSw: | -4.7946 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 54.408 |
InChI Key: | WBSMAKNTOQOARX-UHFFFAOYSA-N |