Name: 4-(4-{5-[2-(5-chloro-2-fluoro-phenyl)-[1,8]naphthyridin-4-yl]-pyridin-3-yl}-pyrazol-1-yl)-piperidine-1-carboxylic acid tert-butyl-ester
SMILES:
CC(C)(C)OC(=O)N1CCC(n2cc(-c3cncc(-c4cc(-c5cc(Cl)ccc5F)nc5ncccc45)c3)cn2)CC1Molecular Processing
Molecular formula
C32H30ClFN6O2
Molecular weight
585.08
Exact mass
584.2103
XLogP
7.59
TPSA
86.03
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
42
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.281
Molar refractivity
160.47
Supplementary Information
Details werden geladen…
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