SMILES:
COc1ncc(Oc2cc(F)c(C(=O)OC(C)(C)C)cc2F)cc1ClMolecular Processing
Molecular formula
C17H16ClF2NO4
Molecular weight
371.77
Exact mass
371.0736
XLogP
4.77
TPSA
57.65
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
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
0.294
Molar refractivity
87.4
Supplementary Information
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