SMILES:
CCCN1CCN(c2ccc(N/C=C3\C(=O)NC(=O)c4ccc(I)cc43)cc2)CC1Molecular Processing
Molecular formula
C23H25IN4O2
Molecular weight
516.38
Exact mass
516.1022
XLogP
3.55
TPSA
64.68
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
128.62
Supplementary Information
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