SMILES:
O=C1N(C(c2ccccc2)c2ccccc2)c2cccc(Br)c2C12COc1cc3c(cc12)OCCO3Molecular Processing
Molecular formula
C30H22BrNO4
Molecular weight
540.41
Exact mass
539.0732
XLogP
6.04
TPSA
48
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
36
Rings
7
Aromatic rings
4
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
140.06
Supplementary Information
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