O=C1CC(C(F)(F)F)CC(=O)N1c1cc(OCSc2ccccc2)c(Cl)cc1F
SMILES: O=C1CC(C(F)(F)F)CC(=O)N1c1cc(OCSc2ccccc2)c(Cl)cc1F

Molecular Processing

Molecular formula
C19H14ClF4NO3S
Molecular weight
447.84
Exact mass
447.0319
XLogP
5.44
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
100.48

Supplementary Information

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