Name: tert-butyl 4-[(2-{5-chloro-4-[5-chloro-2-(difluoromethyl)phenyl]-2-oxopyridin-1(2H)-yl}propanoyl)amino]benzoate
SMILES:
CC(C(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1)n1cc(Cl)c(-c2cc(Cl)ccc2C(F)F)cc1=OMolecular Processing
Molecular formula
C26H24Cl2F2N2O4
Molecular weight
537.39
Exact mass
536.1081
XLogP
6.91
TPSA
77.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
36
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
136.07
Supplementary Information
Details werden geladen…
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