SMILES:
CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)c1ccc2c(c1)C(F)(F)c1cc(Br)ccc1-2Molecular Processing
Molecular formula
C25H24BrF2NO5
Molecular weight
536.37
Exact mass
535.0806
XLogP
5.7
TPSA
72.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
123.83
Supplementary Information
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