CC(C)(Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(CC(O)(c2ccc(-c3ccc(F)cn3)cc2)C(F)F)n1)C(O)C(F)(F)F
SMILES: CC(C)(Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(CC(O)(c2ccc(-c3ccc(F)cn3)cc2)C(F)F)n1)C(O)C(F)(F)F

Molecular Processing

Molecular formula
C42H37F6N3O2
Molecular weight
729.77
Exact mass
729.279
XLogP
9.11
TPSA
71.17
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
12
Heavy atoms
53
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
189.62

Supplementary Information

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