SMILES:
N=C(NS(=O)(=O)c1ccc(F)cc1)C1=NN(c2ccc(Cl)cc2)C(c2ccccc2)C1Molecular Processing
Molecular formula
C22H18ClFN4O2S
Molecular weight
456.93
Exact mass
456.0823
XLogP
4.74
TPSA
85.62
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
119.61
Supplementary Information
Récupération des détails…
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