이름: tert-butyl((5-chloro-4-((6′-chloro-[3,4′-bipyridin]-3′-yl)oxy)-2-fluorophenyl)sulfonyl)(thiazol-2-yl)carbamate
SMILES:
CC(C)(C)OC(=O)N(c1nccs1)S(=O)(=O)c1cc(Cl)c(Oc2cnc(Cl)cc2-c2cccnc2)cc1FMolecular Processing
Molecular formula
C24H19Cl2FN4O5S2
Molecular weight
597.48
Exact mass
596.0158
XLogP
6.97
TPSA
111.58
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
38
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
141.97
Supplementary Information
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