Name: 5-octadecylaminoisophthalic acid
SMILES:
CCCCCCCCCCCCCCCCCCNc1cc(C(=O)O)cc(C(=O)O)c1Molecular Processing
Molecular formula
C26H43NO4
Molecular weight
433.63
Exact mass
433.3192
XLogP
7.76
TPSA
86.63
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
20
Heavy atoms
31
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
128.4
Supplementary Information
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