SMILES:
O=C(Cc1ccccc1)N[C@H]1CON(C2(C(=O)OC(c3ccccc3)c3ccccc3)C=CC(=O)O2)C1=OMolecular Processing
Molecular formula
C29H24N2O7
Molecular weight
512.52
Exact mass
512.1584
XLogP
2.63
TPSA
111.24
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
38
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.172
Molar refractivity
133.66
Supplementary Information
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