SMILES:
CCCC1CCN(CCCCC(=O)c2cc(Cl)c(N)cc2OCc2cc(OC)cc(OC)c2)CC1Molecular Processing
Molecular formula
C28H39ClN2O4
Molecular weight
503.08
Exact mass
502.2598
XLogP
6.38
TPSA
74.02
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
13
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.536
Molar refractivity
142
Supplementary Information
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