O=[N+]([O-])c1ccc(NCCCN2CCOCC2)c(F)c1
الاسم: 2-fluoro-N-(3-morpholinopropyl)-4-nitroaniline
SMILES: O=[N+]([O-])c1ccc(NCCCN2CCOCC2)c(F)c1

Molecular Processing

Molecular formula
C13H18FN3O3
Molecular weight
283.3
Exact mass
283.1332
XLogP
1.87
TPSA
67.64
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
73.42

Supplementary Information

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