Name: 2-[3,5-difluoro-4-(methylthio)phenyl]-1-phenylethanone
SMILES:
CSc1c(F)cc(CC(=O)c2ccccc2)cc1FMolecular Processing
Molecular formula
C15H12F2OS
Molecular weight
278.32
Exact mass
278.0577
XLogP
4.11
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
72.62
Supplementary Information
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