COC(=O)N(C(C)CC(=O)c1ccc(F)cc1)C(C)c1ccc(Br)cc1
SMILES: COC(=O)N(C(C)CC(=O)c1ccc(F)cc1)C(C)c1ccc(Br)cc1

Molecular Processing

Molecular formula
C20H21BrFNO3
Molecular weight
422.29
Exact mass
421.0689
XLogP
5.38
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
101.61

Supplementary Information

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