Nombre: 1-Benzyl-4-[N-ethyl-N-(6-fluoro-3-(nitro)-2-pyridinyl)amino]piperidine
SMILES:
CCN(c1nc(F)ccc1[N+](=O)[O-])C1CCN(Cc2ccccc2)CC1Molecular Processing
Molecular formula
C19H23FN4O2
Molecular weight
358.42
Exact mass
358.1805
XLogP
3.62
TPSA
62.51
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
98.61
Supplementary Information
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