Name: (S)-tert-butyl (1-(7-fluoro-2-(2-(methylsulfonyl)phenyl)quinolin-3-yl)ethyl)-carbamate
SMILES:
C[C@H](NC(=O)OC(C)(C)C)c1cc2ccc(F)cc2nc1-c1ccccc1S(C)(=O)=OMolecular Processing
Molecular formula
C23H25FN2O4S
Molecular weight
444.53
Exact mass
444.1519
XLogP
5.03
TPSA
85.36
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
118.03
Supplementary Information
Details werden geladen…
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