SMILES:
CCOC(=O)C=Cc1cccc(NC(=O)c2ccc(Br)o2)c1Molecular Processing
Molecular formula
C16H14BrNO4
Molecular weight
364.2
Exact mass
363.0106
XLogP
3.87
TPSA
68.54
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
86.47
Supplementary Information
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