SMILES:
O=S(=O)(Nc1ncc(Cl)s1)c1cc(Cl)c(Oc2ccc(Cl)cc2C2CNC2)cc1FMolecular Processing
Molecular formula
C18H13Cl3FN3O3S2
Molecular weight
508.81
Exact mass
506.9448
XLogP
5.52
TPSA
80.32
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
116.48
Supplementary Information
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