SMILES:
CCOC(=O)c1cc2cc(C(CC)(CC)c3ccc(OCC4(C(C)(C)C)OCCO4)c(C)c3)ccc2s1Molecular Processing
Molecular formula
C31H40O5S
Molecular weight
524.72
Exact mass
524.2596
XLogP
7.66
TPSA
53.99
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.516
Molar refractivity
149.91
Supplementary Information
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