COCOc1ccc(C2(C)COc3cc(OCOC)ccc3C2CCCNCCCCCS(=O)CCCC(F)(F)C(F)(F)F)cc1
SMILES: COCOc1ccc(C2(C)COc3cc(OCOC)ccc3C2CCCNCCCCCS(=O)CCCC(F)(F)C(F)(F)F)cc1

Molecular Processing

Molecular formula
C33H46F5NO6S
Molecular weight
679.79
Exact mass
679.2966
XLogP
7.35
TPSA
75.25
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
21
Heavy atoms
46
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
167.55

Supplementary Information

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