이름: (E)-ethyl 3-(4-((6-methoxy-2-(4-methoxyphenyl)-1-oxidobenzo[b]thiophen-3-yl)oxy)phenyl)-2-methylacrylate
SMILES:
CCOC(=O)/C(C)=C/c1ccc(OC2=C(c3ccc(OC)cc3)S(=O)c3cc(OC)ccc32)cc1Molecular Processing
Molecular formula
C28H26O6S
Molecular weight
490.58
Exact mass
490.145
XLogP
5.7
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
136.56
Supplementary Information
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