SMILES:
CCOC(=O)c1c(C)nc2cccc(OCC(C)(C)C(=O)O)c2c1NMolecular Processing
Molecular formula
C18H22N2O5
Molecular weight
346.38
Exact mass
346.1529
XLogP
2.79
TPSA
111.74
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
93.76
Supplementary Information
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