SMILES:
COc1ccc(C(Cc2ccc(Br)cc2)c2cn(C)c(N)n2)cc1Molecular Processing
Molecular formula
C19H20BrN3O
Molecular weight
386.29
Exact mass
385.079
XLogP
4.15
TPSA
53.07
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
100.3
Supplementary Information
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