Cc1ccc(S(=O)(=O)C2CC(C(=O)NC3(C#N)CC3)C(C(=O)N3CCC(F)(F)C3)C2)c(Cl)c1
SMILES: Cc1ccc(S(=O)(=O)C2CC(C(=O)NC3(C#N)CC3)C(C(=O)N3CCC(F)(F)C3)C2)c(Cl)c1

Molecular Processing

Molecular formula
C22H24ClF2N3O4S
Molecular weight
499.97
Exact mass
499.1144
XLogP
2.86
TPSA
107.34
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.591
Molar refractivity
115.24

Supplementary Information

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