N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Compound characteristics
Compound ID: | D223-0119 |
Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide |
Molecular Weight: | 407.78 |
Molecular Formula: | C19 H13 Cl F3 N3 O2 |
Smiles: | [H]N(C(C1C(C=CN(c2cccc(C)c2)N=1)=O)=O)c1cc(ccc1[Cl])C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 4.7513 |
logD: | 2.3907 |
logSw: | -4.9516 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.042 |
InChI Key: | YSMRGZXYYDAGSA-UHFFFAOYSA-N |