ethyl 5-[3-(2,2-dimethylpropanamido)phenyl]-1-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(2,2-dimethylpropanamido)phenyl]-1-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[3-(2,2-dimethylpropanamido)phenyl]-1-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
Compound ID: | V004-0349 |
Compound Name: | ethyl 5-[3-(2,2-dimethylpropanamido)phenyl]-1-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate |
Molecular Weight: | 421.5 |
Molecular Formula: | C24 H27 N3 O4 |
Smiles: | CCOC(c1cc(c2cccc(c2)NC(C(C)(C)C)=O)n(c2ccccc2OC)n1)=O |
Stereo: | ACHIRAL |
logP: | 4.748 |
logD: | 4.748 |
logSw: | -4.4374 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.507 |
InChI Key: | NJQOPLABWOLISX-UHFFFAOYSA-N |