SMILES:
CCOC(=O)CCCOc1ccc(C2=NNC(=O)CC2)cc1Molecular Processing
Molecular formula
C16H20N2O4
Molecular weight
304.35
Exact mass
304.1423
XLogP
2.02
TPSA
76.99
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
81.72
Supplementary Information
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