Name: product
SMILES:
CC(=O)Nc1c([N+](=O)[O-])cc(Br)c2c1CCN(C)C2Molecular Processing
Molecular formula
C12H14BrN3O3
Molecular weight
328.17
Exact mass
327.0219
XLogP
2.3
TPSA
75.48
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
75.14
Supplementary Information
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Involved in 2 reactions→