Name: methyl 6-chloro-5′-methyl-3,3′-bipyridine-5-carboxylate
SMILES:
COC(=O)c1cc(-c2cncc(C)c2)cnc1ClMolecular Processing
Molecular formula
C13H11ClN2O2
Molecular weight
262.7
Exact mass
262.0509
XLogP
2.89
TPSA
52.08
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
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
0.154
Molar refractivity
68.55
Supplementary Information
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