이름: N-tert-butyl-3-{4-[4-trifluoromethyl-6-(3-trifluoromethyl-phenyl)-pyrimidin-2-yl]-pyridin-2-yl}-benzenesulfonamide
SMILES:
CC(C)(C)NS(=O)(=O)c1cccc(-c2cc(-c3nc(-c4cccc(C(F)(F)F)c4)cc(C(F)(F)F)n3)ccn2)c1Molecular Processing
Molecular formula
C27H22F6N4O2S
Molecular weight
580.55
Exact mass
580.1368
XLogP
6.99
TPSA
84.84
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
136.21
Supplementary Information
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