SMILES:
Cc1nc2c([N+](=O)[O-])cc(Br)cc2n1Cc1cccc(Cl)c1ClMolecular Processing
Molecular formula
C15H10BrCl2N3O2
Molecular weight
415.07
Exact mass
412.9333
XLogP
5.37
TPSA
60.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
94.39
Supplementary Information
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