SMILES:
CN1Cc2c(C=O)ncn2-c2cccc(C(F)(F)F)c2C1=OMolecular Processing
Molecular formula
C14H10F3N3O2
Molecular weight
309.25
Exact mass
309.0725
XLogP
2.29
TPSA
55.2
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
69.75
Supplementary Information
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