O=C(C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2ccccc2)CC1
SMILES: O=C(C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2ccccc2)CC1

Molecular Processing

Molecular formula
C34H35F6N3O2
Molecular weight
631.66
Exact mass
631.2633
XLogP
6.62
TPSA
44.81
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
45
Rings
6
Aromatic rings
3
Saturated rings
3
Aliphatic rings
3
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.441
Molar refractivity
155.71

Supplementary Information

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