C[C@@]1(c2nc(NC(=O)c3ncc(C(F)(F)F)cc3Cl)ccc2F)C[C@@H](C(F)(F)F)OC(N)=N1
SMILES: C[C@@]1(c2nc(NC(=O)c3ncc(C(F)(F)F)cc3Cl)ccc2F)C[C@@H](C(F)(F)F)OC(N)=N1

Molecular Processing

Molecular formula
C18H13ClF7N5O2
Molecular weight
499.77
Exact mass
499.0646
XLogP
4.42
TPSA
102.49
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
100.92

Supplementary Information

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