SMILES:
O=[N+]([O-])c1ccc(NCCNc2ccc(-c3ncc[nH]3)c(-c3ccc(Cl)cc3Cl)n2)nc1Molecular Processing
Molecular formula
C21H17Cl2N7O2
Molecular weight
470.32
Exact mass
469.0821
XLogP
5.27
TPSA
121.66
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
125.15
Supplementary Information
Details werden geladen…
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