SMILES:
CC(C)(C)OC(=O)N1CC(F)(F)CC1C(=O)OCC(=O)c1ccc2cc(Br)ccc2c1Molecular Processing
Molecular formula
C22H22BrF2NO5
Molecular weight
498.32
Exact mass
497.0649
XLogP
4.97
TPSA
72.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
113.23
Supplementary Information
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