SMILES:
CCOC(=O)CC(=O)c1cccc(-n2ccnn2)c1Molecular Processing
Molecular formula
C13H13N3O3
Molecular weight
259.27
Exact mass
259.0957
XLogP
1.4
TPSA
74.08
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
66.94
Supplementary Information
Details werden geladen…
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