이름: ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylate
SMILES:
CCOC(=O)c1cn(C2CC2)c2cc(F)c(F)cc2c1=OMolecular Processing
Molecular formula
C15H13F2NO3
Molecular weight
293.27
Exact mass
293.0863
XLogP
2.79
TPSA
48.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
72.35
Supplementary Information
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