CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C(C)C(C)=O)c2nc(C)nn12
SMILES: CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C(C)C(C)=O)c2nc(C)nn12

Molecular Processing

Molecular formula
C28H28N6O4
Molecular weight
512.57
Exact mass
512.2172
XLogP
3.9
TPSA
128.15
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
38
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
142.17

Supplementary Information

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