الاسم: N-(2-diethylamino-ethyl)-4-carboxy-acetylamino-5-iodo-2-methoxy-benzamide
SMILES:
CCN(CC)CCNC(=O)c1cc(I)c(C(=O)O)c(NC(C)=O)c1OCMolecular Processing
Molecular formula
C17H24IN3O5
Molecular weight
477.3
Exact mass
477.0761
XLogP
2.03
TPSA
107.97
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
26
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
107.1
Supplementary Information
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