Name: 1-(3-(4-Chloro-phenyl)-1-{3-[4-(2-fluoro-phenyl)-Piperazin-1-yl]-propyl}-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl)-ethanone
SMILES:
CC(=O)N1CCc2c(c(-c3ccc(Cl)cc3)nn2CCCN2CCN(c3ccccc3F)CC2)C1Molecular Processing
Molecular formula
C27H31ClFN5O
Molecular weight
496.03
Exact mass
495.2201
XLogP
4.46
TPSA
44.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.407
Molar refractivity
137.14
Supplementary Information
Details werden geladen…
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