الاسم: 1-(5-(4-bromo-3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl)-2-methoxy-2-(4-morpholinophenyl)ethanol
SMILES:
COc1cc(-c2nc(C(O)C(OC)c3ccc(N4CCOCC4)cc3)no2)cc(OC)c1BrMolecular Processing
Molecular formula
C23H26BrN3O6
Molecular weight
520.38
Exact mass
519.1005
XLogP
3.77
TPSA
99.31
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
124.72
Supplementary Information
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