이름: compound 6c
SMILES:
C[n+]1cccc(C(=O)NCCc2ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c2)c1.[I-]Molecular Processing
Molecular formula
C25H33IN2O5
Molecular weight
568.45
Exact mass
568.1434
XLogP
0.39
TPSA
85.58
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.44
Molar refractivity
120.28
Supplementary Information
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