SMILES:
CCOC(=O)c1cn(C(C)c2c(F)cccc2F)nn1Molecular Processing
Molecular formula
C13H13F2N3O2
Molecular weight
281.26
Exact mass
281.0976
XLogP
2.34
TPSA
57.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
66.15
Supplementary Information
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