SMILES:
CCOC(=O)CN(Cc1ccc(OC)cc1)Cc1cc(Br)cnc1NMolecular Processing
Molecular formula
C18H22BrN3O3
Molecular weight
408.3
Exact mass
407.0845
XLogP
3
TPSA
77.68
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
100.09
Supplementary Information
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