Nc1cc(F)c(C2=CCSCC2)c(F)c1
Name: 4-(3,6-dihydro-2H-thiopyran-4-yl)-3,5-difluorobenzenamine
SMILES: Nc1cc(F)c(C2=CCSCC2)c(F)c1

Molecular Processing

Molecular formula
C11H11F2NS
Molecular weight
227.28
Exact mass
227.058
XLogP
3.07
TPSA
26.02
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
60.69

Supplementary Information

Details werden geladen…

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