Cc1cc2c(cc1C(F)(F)F)NCCCC2N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnn(C)n1
SMILES: Cc1cc2c(cc1C(F)(F)F)NCCCC2N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnn(C)n1

Molecular Processing

Molecular formula
C23H21F9N6
Molecular weight
552.44
Exact mass
552.1684
XLogP
6.53
TPSA
58.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
118.07

Supplementary Information

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