SMILES:
O=C(N[C@@H]1CCCN2c3cc(Cl)ccc3Nc3ccccc3[C@H]12)C(F)(F)FMolecular Processing
Molecular formula
C19H17ClF3N3O
Molecular weight
395.81
Exact mass
395.1012
XLogP
4.79
TPSA
44.37
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
98.48
Supplementary Information
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