Nombre: 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-2-thioxo -4-thiazolidinone
SMILES:
CC(C)(C)c1cc(CC2SC(=S)NC2=O)cc(C(C)(C)C)c1OMolecular Processing
Molecular formula
C18H25NO2S2
Molecular weight
351.54
Exact mass
351.1327
XLogP
4.05
TPSA
49.33
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
101.33
Supplementary Information
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