SMILES:
O=C(c1cccc(C(F)(F)F)c1Cl)N1CCc2c(nnn2-c2ccccc2)C1Molecular Processing
Molecular formula
C19H14ClF3N4O
Molecular weight
406.8
Exact mass
406.0808
XLogP
4.14
TPSA
51.02
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
96.26
Supplementary Information
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