名称: ethyl 1-cyclopropyl-6,7,8-trifluoro-5-ethyl-1,4-dihydro-4 -oxoquinoline-3-carboxylate
SMILES:
CCOC(=O)c1cn(C2CC2)c2c(F)c(F)c(F)c(CC)c2c1=OMolecular Processing
Molecular formula
C17H16F3NO3
Molecular weight
339.31
Exact mass
339.1082
XLogP
3.49
TPSA
48.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
81.69
Supplementary Information
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