الاسم: tert-butyl 2-{4-[5-chloro-2-(difluoromethoxy)phenyl]-5-methoxy-2-oxopyridin-1(2H)-yl}-3-[(2R)-tetrahydro-2H-pyran-2-yl]propanoate
SMILES:
COc1cn(C(C[C@H]2CCCCO2)C(=O)OC(C)(C)C)c(=O)cc1-c1cc(Cl)ccc1OC(F)FMolecular Processing
Molecular formula
C25H30ClF2NO6
Molecular weight
513.97
Exact mass
513.173
XLogP
5.62
TPSA
75.99
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.52
Molar refractivity
127.42
Supplementary Information
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