Name: 2-benzyl-4-carboxy-6-(4-fluoro-3-methylphenyl)-2H-pyridazin-3-one
SMILES:
Cc1cc(-c2cc(C(=O)O)c(=O)n(Cc3ccccc3)n2)ccc1FMolecular Processing
Molecular formula
C19H15FN2O3
Molecular weight
338.34
Exact mass
338.1067
XLogP
3.1
TPSA
72.19
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
91.13
Supplementary Information
Details werden geladen…
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