SMILES:
CCC1c2cc(F)ccc2-c2ccccc2N1S(=O)(=O)c1ccc(O)c(Cl)c1Molecular Processing
Molecular formula
C21H17ClFNO3S
Molecular weight
417.89
Exact mass
417.0602
XLogP
5.51
TPSA
57.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
107.65
Supplementary Information
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