SMILES:
CC(C)Cc1ccc(C(C)C(=O)Oc2ccc(C(N)=S)cc2)cc1Molecular Processing
Molecular formula
C20H23NO2S
Molecular weight
341.48
Exact mass
341.1449
XLogP
4.23
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
101.36
Supplementary Information
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