SMILES:
CCOC(=O)c1cc2cc(C(CC)(CC)c3ccc(OCC(=O)C(C)(C)C)c(C)c3)ccc2s1Molecular Processing
Molecular formula
C29H36O4S
Molecular weight
480.67
Exact mass
480.2334
XLogP
7.49
TPSA
52.6
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
34
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
140.28
Supplementary Information
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