Name: methyl 4-amino-3-chloro-6-(3-fluoro-4-formylphenyl)-5-methylpicolinate
SMILES:
COC(=O)c1nc(-c2ccc(C=O)c(F)c2)c(C)c(N)c1ClMolecular Processing
Molecular formula
C15H12ClFN2O3
Molecular weight
322.72
Exact mass
322.052
XLogP
3.03
TPSA
82.28
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
80.52
Supplementary Information
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