SMILES:
COc1cc(N)c(Br)cc1C(=O)Nc1cccc2c1CCN(C)C2Molecular Processing
Molecular formula
C18H20BrN3O2
Molecular weight
390.28
Exact mass
389.0739
XLogP
3.28
TPSA
67.59
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
99.54
Supplementary Information
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