Name: 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-4-thiazolidinone
SMILES:
CC(C)(C)c1cc(CC2SCNC2=O)cc(C(C)(C)C)c1OMolecular Processing
Molecular formula
C18H27NO2S
Molecular weight
321.49
Exact mass
321.1763
XLogP
3.72
TPSA
49.33
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
93.6
Supplementary Information
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Involved in 4 reactions→