Name: ethyl 1-(3,4-dichlorophenyl)-1,4-dihydro-4-oxo-7-(4- pyridinyl)-3-quinolinecarboxylate
SMILES:
CCOC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)c2cc(-c3ccncc3)ccc2c1=OMolecular Processing
Molecular formula
C23H16Cl2N2O3
Molecular weight
439.3
Exact mass
438.0538
XLogP
5.54
TPSA
61.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.087
Molar refractivity
118.75
Supplementary Information
Details werden geladen…
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