CC1(C)CC(S(=O)(=O)Cc2c(C(F)(F)F)nn(-c3ccccc3)c2Cl)=NO1
SMILES: CC1(C)CC(S(=O)(=O)Cc2c(C(F)(F)F)nn(-c3ccccc3)c2Cl)=NO1

Molecular Processing

Molecular formula
C16H15ClF3N3O3S
Molecular weight
421.83
Exact mass
421.0475
XLogP
3.97
TPSA
73.55
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
93.42

Supplementary Information

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