SMILES:
CCOC(=O)CCCc1cc(C(=O)c2ccc(O)cc2)c2ccccn12Molecular Processing
Molecular formula
C21H21NO4
Molecular weight
351.4
Exact mass
351.1471
XLogP
3.76
TPSA
68.01
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
98.51
Supplementary Information
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