SMILES:
C=C1COc2ccc(C(=O)OC)cc2C(Cc2ccccc2)(S(=O)(=O)c2ccccc2)C1Molecular Processing
Molecular formula
C26H24O5S
Molecular weight
448.54
Exact mass
448.1344
XLogP
4.72
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
122.49
Supplementary Information
Details werden geladen…
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