COCC1CN(c2ccc(C(F)(F)F)cc2)CC2(CCN(C(=O)c3ccc(OC(C)C)c(C)c3)CC2)O1
SMILES: COCC1CN(c2ccc(C(F)(F)F)cc2)CC2(CCN(C(=O)c3ccc(OC(C)C)c(C)c3)CC2)O1

Molecular Processing

Molecular formula
C28H35F3N2O4
Molecular weight
520.59
Exact mass
520.2549
XLogP
5.33
TPSA
51.24
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.536
Molar refractivity
135.22

Supplementary Information

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