SMILES:
O=c1[nH]c(=O)n(CCCN2C[C@@H]3C[C@]3(c3ccc(C(F)(F)F)cc3)C2)cc1-c1ccccc1FMolecular Processing
Molecular formula
C25H23F4N3O2
Molecular weight
473.47
Exact mass
473.1726
XLogP
4.03
TPSA
58.1
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
119
Supplementary Information
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