Name: methyl 4-amino-5-fluoro-6-(4-formylphenyl)-3-vinylpicolinate
SMILES:
C=Cc1c(C(=O)OC)nc(-c2ccc(C=O)cc2)c(F)c1NMolecular Processing
Molecular formula
C16H13FN2O3
Molecular weight
300.29
Exact mass
300.091
XLogP
2.71
TPSA
82.28
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
80.86
Supplementary Information
Details werden geladen…
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