ethyl 5-(4-ethylphenyl)-1-{4-[methyl(2-methylpropyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-ethylphenyl)-1-{4-[methyl(2-methylpropyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
ethyl 5-(4-ethylphenyl)-1-{4-[methyl(2-methylpropyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Compound characteristics
Compound ID: | V004-9513 |
Compound Name: | ethyl 5-(4-ethylphenyl)-1-{4-[methyl(2-methylpropyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate |
Molecular Weight: | 433.55 |
Molecular Formula: | C26 H31 N3 O3 |
Smiles: | CCc1ccc(cc1)c1cc(C(=O)OCC)nn1c1ccc(cc1)C(N(C)CC(C)C)=O |
Stereo: | ACHIRAL |
logP: | 5.4976 |
logD: | 5.4976 |
logSw: | -5.3695 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.237 |
InChI Key: | WJSYEOAHIRQANX-UHFFFAOYSA-N |