SMILES:
COC(=O)C(=Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1)C(=O)OCMolecular Processing
Molecular formula
C24H23NO6
Molecular weight
421.45
Exact mass
421.1525
XLogP
4
TPSA
87.86
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
114.33
Supplementary Information
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