CCC(O)(c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(-c4ccccc4)nc3c2)nn1)C(F)(F)F
SMILES: CCC(O)(c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(-c4ccccc4)nc3c2)nn1)C(F)(F)F

Molecular Processing

Molecular formula
C28H22F4N4O
Molecular weight
506.5
Exact mass
506.173
XLogP
6.51
TPSA
63.83
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
37
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
131.94

Supplementary Information

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