الاسم: ( 5 )
SMILES:
COC1C(=O)NN=C(c2ccc(C)c(F)c2)C1=C=OMolecular Processing
Molecular formula
C13H11FN2O3
Molecular weight
262.24
Exact mass
262.0754
XLogP
0.74
TPSA
67.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
65.82
Supplementary Information
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