CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCC(OCC(C)=O)CC2)c2ccnn12
SMILES: CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCC(OCC(C)=O)CC2)c2ccnn12

Molecular Processing

Molecular formula
C33H35N5O5
Molecular weight
581.67
Exact mass
581.2638
XLogP
5.14
TPSA
124.49
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
43
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
162.17

Supplementary Information

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