O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1ccc(F)c(Br)c1
Name: 3-bromo-N-(4-(chlorodifluoromethoxy)phenyl)-4-fluorobenzamide
SMILES: O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1ccc(F)c(Br)c1

Molecular Processing

Molecular formula
C14H8BrClF3NO2
Molecular weight
394.57
Exact mass
392.9379
XLogP
5.01
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
22
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
0.071
Molar refractivity
79.92

Supplementary Information

Details werden geladen…

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