Name: [2-(4-Bromo-phenyl)-2-(4-chloro-phenyl)-ethyl]-methyl-amine
SMILES:
CNCC(c1ccc(Cl)cc1)c1ccc(Br)cc1Molecular Processing
Molecular formula
C15H15BrClN
Molecular weight
324.65
Exact mass
323.0076
XLogP
4.45
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
81.36
Supplementary Information
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