Name: 1-(4-chloro-3-ethyl-5,7-difluoroquinolin-2-yl)piperidin-2-one
SMILES:
CCc1c(N2CCCCC2=O)nc2cc(F)cc(F)c2c1ClMolecular Processing
Molecular formula
C16H15ClF2N2O
Molecular weight
324.76
Exact mass
324.0841
XLogP
4.25
TPSA
33.2
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
22
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
0.375
Molar refractivity
82.25
Supplementary Information
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