Name: 3-(4-chloro-2-fluorophenyl)-6-trifluoromethyl-2-oxo-1,2-dihydropyrazine
SMILES:
O=c1[nH]c(C(F)(F)F)cnc1-c1ccc(Cl)cc1FMolecular Processing
Molecular formula
C11H5ClF4N2O
Molecular weight
292.62
Exact mass
292.0027
XLogP
3.25
TPSA
45.75
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
60.26
Supplementary Information
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