SMILES:
CCC(CC)(c1ccc(OCC(=O)C(C)(C)C)c(C)c1)c1cc2cc(OC)ccc2s1Molecular Processing
Molecular formula
C27H34O3S
Molecular weight
438.63
Exact mass
438.2229
XLogP
7.32
TPSA
35.53
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
130.88
Supplementary Information
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