SMILES:
COc1cc(-c2ccc(C(=O)C(OC)c3cccc4ncccc34)o2)cc(OC)c1BrMolecular Processing
Molecular formula
C24H20BrNO5
Molecular weight
482.33
Exact mass
481.0525
XLogP
5.84
TPSA
70.79
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
120.77
Supplementary Information
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Involved in 5 reactions→