이름: ethyl 1-cyclopropyl-7-chloro-6-fluoro-8-methoxy-1,4-dihydro-4-oxo-3-quinolinecarboxylate
SMILES:
CCOC(=O)c1cn(C2CC2)c2c(OC)c(Cl)c(F)cc2c1=OMolecular Processing
Molecular formula
C16H15ClFNO4
Molecular weight
339.75
Exact mass
339.0674
XLogP
3.31
TPSA
57.53
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
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
0.375
Molar refractivity
83.96
Supplementary Information
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