N-[3-tert-butyl-1-(2,5-dichlorophenyl)-1H-pyrazol-5-yl]-2,3-dichlorobenzamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(2,5-dichlorophenyl)-1H-pyrazol-5-yl]-2,3-dichlorobenzamide
N-[3-tert-butyl-1-(2,5-dichlorophenyl)-1H-pyrazol-5-yl]-2,3-dichlorobenzamide
Compound characteristics
Compound ID: | V010-3486 |
Compound Name: | N-[3-tert-butyl-1-(2,5-dichlorophenyl)-1H-pyrazol-5-yl]-2,3-dichlorobenzamide |
Molecular Weight: | 457.18 |
Molecular Formula: | C20 H17 Cl4 N3 O |
Smiles: | CC(C)(C)c1cc(NC(c2cccc(c2[Cl])[Cl])=O)n(c2cc(ccc2[Cl])[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 7.2002 |
logD: | 5.5869 |
logSw: | -6.6695 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.464 |
InChI Key: | QMYQEHZMNJGSCZ-UHFFFAOYSA-N |