Название: 4-(4-acetamidophenyl)-2-amino-3-cyanofurane
SMILES:
CC(=O)Nc1ccc(-c2coc(N)c2C#N)cc1Molecular Processing
Molecular formula
C13H11N3O2
Molecular weight
241.25
Exact mass
241.0851
XLogP
2.36
TPSA
92.05
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
67.58
Supplementary Information
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