SMILES:
CNC(=O)c1ccccc1Nc1nc(Cl)ncc1C(F)(F)FMolecular Processing
Molecular formula
C13H10ClF3N4O
Molecular weight
330.7
Exact mass
330.0495
XLogP
3.25
TPSA
66.91
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
75.16
Supplementary Information
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