Name: (7RS,9aSR)-7-(4-fluorophenoxy)methyl-2-(6-chloropyridazin-3-yl)-2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine
SMILES:
Fc1ccc(OCC2CCC3CN(c4ccc(Cl)nn4)CCN3C2)cc1Molecular Processing
Molecular formula
C19H22ClFN4O
Molecular weight
376.86
Exact mass
376.1466
XLogP
3.25
TPSA
41.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
99.24
Supplementary Information
Details werden geladen…
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