CN1CCN(CC1)C2=C(C(=C(C=C2)[N+](=O)[O-])N)F
CAS: 611226-17-6
Название: 2-fluoro-3-(4-methylpiperazin-1-yl)-6-nitroaniline
SMILES: CN1CCN(CC1)C2=C(C(=C(C=C2)[N+](=O)[O-])N)F

Molecular Processing

Molecular formula
C11H15FN4O2
Molecular weight
254.26
Exact mass
254.1179
XLogP
1.07
TPSA
75.64
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
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
0.455
Molar refractivity
67.18

Supplementary Information

InChIKey: AQRGYIVMIMMJBP-UHFFFAOYSA-N
Синонимы
SCHEMBL2892379AQRGYIVMIMMJBP-UHFFFAOYSA-NDB-1347432-Fluoro-3-(4-methyl-1-piperazinyl)-6-nitrobenzenamine2-Fluoro-3-(4-methyl-piperazin-1-yl)-6-nitro-phenylamine611226-17-6
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