CCOC(=O)C1CCCc2sc(-c3ccc(C(F)(F)F)cc3)nc21
SMILES: CCOC(=O)C1CCCc2sc(-c3ccc(C(F)(F)F)cc3)nc21

Molecular Processing

Molecular formula
C17H16F3NO2S
Molecular weight
355.38
Exact mass
355.0854
XLogP
4.81
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
84.86

Supplementary Information

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