CCOC(=O)C1=C(COc2cccnc2)NC(COc2cccnc2)=C(C(=O)OCC)C1c1cccc([N+](=O)[O-])c1
SMILES: CCOC(=O)C1=C(COc2cccnc2)NC(COc2cccnc2)=C(C(=O)OCC)C1c1cccc([N+](=O)[O-])c1

Molecular Processing

Molecular formula
C29H28N4O8
Molecular weight
560.56
Exact mass
560.1907
XLogP
3.86
TPSA
152.01
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
12
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
145.76

Supplementary Information

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