Name: 3-(4-bromo-phenyl)-3-(4-chloro-phenyl)-N-methyl-propionamide
SMILES:
CNC(=O)CC(c1ccc(Cl)cc1)c1ccc(Br)cc1Molecular Processing
Molecular formula
C16H15BrClNO
Molecular weight
352.66
Exact mass
351.0026
XLogP
4.37
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
86.12
Supplementary Information
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