SMILES:
O=C(NCCSSCCNC(=O)c1ccc(OC(F)(F)F)cc1)c1ccc(OC(F)(F)F)cc1Molecular Processing
Molecular formula
C20H18F6N2O4S2
Molecular weight
528.5
Exact mass
528.0612
XLogP
5.03
TPSA
76.66
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
34
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
115.83
Supplementary Information
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