SMILES:
COc1cc(C=C(N)C(N)=Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c([N+](=O)[O-])cc1OCMolecular Processing
Molecular formula
C20H22N4O8
Molecular weight
446.42
Exact mass
446.1438
XLogP
2.84
TPSA
175.24
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
9
Heavy atoms
32
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
116.73
Supplementary Information
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