Nombre: Compound 13
SMILES:
CCOC(=O)COc1nc(C(C)C)c(N)c(C(C)C)n1Molecular Processing
Molecular formula
C14H23N3O3
Molecular weight
281.36
Exact mass
281.1739
XLogP
2.25
TPSA
87.33
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
76.75
Supplementary Information
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