名称: 2-bromo-5-chloro-4-[(4-chlorophenylthio)(2,5-difluorophenyl)methyl]pyridine
SMILES:
Fc1ccc(F)c(C(Sc2ccc(Cl)cc2)c2cc(Br)ncc2Cl)c1Molecular Processing
Molecular formula
C18H10BrCl2F2NS
Molecular weight
461.16
Exact mass
458.9062
XLogP
7.31
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.056
Molar refractivity
102.46
Supplementary Information
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