SMILES:
COc1cc2c3c(cccc3c1N1CCOCC1)C(=O)N(OCc1ccccc1)C2=OMolecular Processing
Molecular formula
C24H22N2O5
Molecular weight
418.45
Exact mass
418.1529
XLogP
3.41
TPSA
68.31
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
31
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
115.26
Supplementary Information
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