Name: dimethyl 5-bromo-7-ethyl-4-hydroxyquinoline-2,3-dicarboxylate
SMILES:
CCc1cc(Br)c2c(O)c(C(=O)OC)c(C(=O)OC)nc2c1Molecular Processing
Molecular formula
C15H14BrNO5
Molecular weight
368.18
Exact mass
367.0055
XLogP
2.84
TPSA
85.72
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
83.16
Supplementary Information
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