SMILES:
CC1Cc2cc3c(cc2C(c2ccc([N+](=O)[O-])cc2)=NN1C1=NCCO1)OCO3Molecular Processing
Molecular formula
C20H18N4O5
Molecular weight
394.39
Exact mass
394.1277
XLogP
2.71
TPSA
98.79
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
2
Heavy atoms
29
Rings
5
Aromatic rings
2
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
104.56
Supplementary Information
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