SMILES:
Cc1c(-c2ccc(C(=O)N3CCC[C@H]3CN3CCCC3)s2)noc1C(F)(F)FMolecular Processing
Molecular formula
C19H22F3N3O2S
Molecular weight
413.46
Exact mass
413.1385
XLogP
4.43
TPSA
49.58
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
99.29
Supplementary Information
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