CC(C)(C)c1cc(SCCC(=O)NN)cc(C(C)(C)C)c1O
名称: 3-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]propanoic acid hydrazide
SMILES: CC(C)(C)c1cc(SCCC(=O)NN)cc(C(C)(C)C)c1O

Molecular Processing

Molecular formula
C17H28N2O2S
Molecular weight
324.49
Exact mass
324.1871
XLogP
3.46
TPSA
75.35
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
93.18

Supplementary Information

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