Name: (4-(4-fluorobenzyl)piperazin-1-yl)(6-bromopyridin-3-yl)methanone
SMILES:
O=C(c1ccc(Br)nc1)N1CCN(Cc2ccc(F)cc2)CC1Molecular Processing
Molecular formula
C17H17BrFN3O
Molecular weight
378.25
Exact mass
377.0539
XLogP
2.94
TPSA
36.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
89.52
Supplementary Information
Details werden geladen…
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