SMILES:
COC(=O)C1CC1CN1CCN(c2csc3cc(C(F)(F)F)ccc23)CC1Molecular Processing
Molecular formula
C19H21F3N2O2S
Molecular weight
398.45
Exact mass
398.1276
XLogP
3.85
TPSA
32.78
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
99.09
Supplementary Information
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