이름: 5-(4-{2-[1-(4-hydroxyphenyl)ethylideneaminooxy]ethoxy}benzyl)thiazolidine-2,4-dione
SMILES:
CC(=NOCCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccc(O)cc1Molecular Processing
Molecular formula
C20H20N2O5S
Molecular weight
400.46
Exact mass
400.1093
XLogP
3.11
TPSA
97.22
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
106.83
Supplementary Information
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