CC(C)S(=O)(=O)NCc1cnc(C(F)F)c(-c2nn(-c3ccc(C(F)(F)F)cc3)c(=O)[nH]2)c1
이름: title compound
SMILES: CC(C)S(=O)(=O)NCc1cnc(C(F)F)c(-c2nn(-c3ccc(C(F)(F)F)cc3)c(=O)[nH]2)c1

Molecular Processing

Molecular formula
C19H18F5N5O3S
Molecular weight
491.44
Exact mass
491.1051
XLogP
3.41
TPSA
109.74
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
108.27

Supplementary Information

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