الاسم: product
SMILES:
CCOC(=O)C(=O)C[n+]1c(N)c(C(N)=O)nc2ccccc21.[Br-]Molecular Processing
Molecular formula
C14H15BrN4O4
Molecular weight
383.2
Exact mass
382.0277
XLogP
-3.66
TPSA
129.25
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.214
Molar refractivity
76.51
Supplementary Information
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