Cc1cc2c(cc1O)c(C#N)c(-c1ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cn1)n2C1CCCC1
SMILES: Cc1cc2c(cc1O)c(C#N)c(-c1ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cn1)n2C1CCCC1

Molecular Processing

Molecular formula
C23H23F3N4O3S
Molecular weight
492.52
Exact mass
492.1443
XLogP
4.93
TPSA
108.01
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
119.63

Supplementary Information

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