Brc1ccc(C2(c3ccc(Br)cc3)c3ccccc3-n3c4ccccc4c4cccc2c43)cc1
SMILES: Brc1ccc(C2(c3ccc(Br)cc3)c3ccccc3-n3c4ccccc4c4cccc2c43)cc1

Molecular Processing

Molecular formula
C31H19Br2N
Molecular weight
565.31
Exact mass
562.9884
XLogP
9
TPSA
4.93
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
2
Heavy atoms
34
Rings
7
Aromatic rings
6
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.032
Molar refractivity
148.05

Supplementary Information

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