SMILES:
COc1cc(C2=Cc3ccc(OCc4ccccc4)cc3CC2)c([N+](=O)[O-])cc1OCMolecular Processing
Molecular formula
C25H23NO5
Molecular weight
417.46
Exact mass
417.1576
XLogP
5.68
TPSA
70.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
119.61
Supplementary Information
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