SMILES:
O=C(O)c1ccc(-c2c(/C=C/c3ccc4ccccc4n3)nc3c(N4CCOCC4)ccnn23)cc1OMolecular Processing
Molecular formula
C28H23N5O4
Molecular weight
493.52
Exact mass
493.175
XLogP
4.36
TPSA
113.08
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
37
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
140.75
Supplementary Information
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