SMILES:
CCOCCC1(Oc2ccc(Oc3ccc(-c4nnco4)cc3)cc2)C(=O)NC(=O)NC1=OMolecular Processing
Molecular formula
C22H20N4O7
Molecular weight
452.42
Exact mass
452.1332
XLogP
2.44
TPSA
141.88
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
112.4
Supplementary Information
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