이름: 1-[(6-Bromo-3-nitroquinolin-4-yl)amino]-2-methylpropan-2-ol
SMILES:
CC(C)(O)CNc1c([N+](=O)[O-])cnc2ccc(Br)cc12Molecular Processing
Molecular formula
C13H14BrN3O3
Molecular weight
340.18
Exact mass
339.0219
XLogP
3.09
TPSA
88.29
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
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
0.308
Molar refractivity
80.88
Supplementary Information
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