Brc1cccc2c1sc1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc12
SMILES: Brc1cccc2c1sc1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc12

Molecular Processing

Molecular formula
C30H18BrNS
Molecular weight
504.45
Exact mass
503.0343
XLogP
9.58
TPSA
4.93
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
33
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
146.81

Supplementary Information

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