SMILES:
CCCCCCC(=O)NCc1ccc2nc(C)n(C3CCC(=O)NC3=O)c(=O)c2c1Molecular Processing
Molecular formula
C22H28N4O4
Molecular weight
412.49
Exact mass
412.2111
XLogP
2.27
TPSA
110.16
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
112.77
Supplementary Information
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