Name: ethyl 8-chloro-1-(3,5-difluoro-6-methoxypyridine-2-yl)-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
SMILES:
CCOC(=O)c1cn(-c2nc(OC)c(F)cc2F)c2c(Cl)c(F)c(F)cc2c1=OMolecular Processing
Molecular formula
C18H11ClF4N2O4
Molecular weight
430.74
Exact mass
430.0343
XLogP
3.78
TPSA
70.42
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
94.69
Supplementary Information
Details werden geladen…
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