Name: 2-isobutyl-4-methoxycarbonyl-6-phenyl-2H-pyridazin-3-one
SMILES:
COC(=O)c1cc(-c2ccccc2)nn(CC(C)C)c1=OMolecular Processing
Molecular formula
C16H18N2O3
Molecular weight
286.33
Exact mass
286.1317
XLogP
2.35
TPSA
61.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
80.11
Supplementary Information
Details werden geladen…
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