SMILES:
CCOC(=O)Cc1ccc(C)c(Oc2cc(Cl)cc(C#N)c2)c1FMolecular Processing
Molecular formula
C18H15ClFNO3
Molecular weight
347.77
Exact mass
347.0724
XLogP
4.56
TPSA
59.32
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
87.72
Supplementary Information
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