SMILES:
O=C1CC(c2ccc(Br)cc2)(N2C(=O)c3ccccc3C2=O)C1Molecular Processing
Molecular formula
C18H12BrNO3
Molecular weight
370.2
Exact mass
369.0001
XLogP
3.3
TPSA
54.45
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
87
Supplementary Information
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