O=C1NC(=O)C(=Cc2ccc(O)cc2)S1
이름: 5-(4-hydroxybenzylidene)-2,4-thiazolidinedione
SMILES: O=C1NC(=O)C(=Cc2ccc(O)cc2)S1

Molecular Processing

Molecular formula
C10H7NO3S
Molecular weight
221.24
Exact mass
221.0147
XLogP
1.72
TPSA
66.4
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
57.21

Supplementary Information

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