COc1cc2c(cc1OCc1ccccc1)C(C1(c3ccc(OC(F)(F)F)cc3)CCC1)N(C)CC2
SMILES: COc1cc2c(cc1OCc1ccccc1)C(C1(c3ccc(OC(F)(F)F)cc3)CCC1)N(C)CC2

Molecular Processing

Molecular formula
C29H30F3NO3
Molecular weight
497.56
Exact mass
497.2178
XLogP
6.82
TPSA
30.93
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
131.5

Supplementary Information

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