SMILES:
CC(C)(C)Cc1c[nH]c(CC(O)(c2ccc(-c3ccc(F)cn3)cc2)C(F)(F)F)n1Molecular Processing
Molecular formula
C22H23F4N3O
Molecular weight
421.44
Exact mass
421.1777
XLogP
5.19
TPSA
61.8
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
105.03
Supplementary Information
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