SMILES:
Cc1nc(N2CCN(Cc3ccc(OC(F)(F)F)cc3)C2=O)sc1C(=O)Nc1ccccc1Molecular Processing
Molecular formula
C22H19F3N4O3S
Molecular weight
476.48
Exact mass
476.113
XLogP
5.04
TPSA
74.77
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
117.52
Supplementary Information
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