CCOC(=O)Cc1ccc(OC)c(-c2ccc(C(F)(F)F)cc2CSc2ccccc2)c1
SMILES: CCOC(=O)Cc1ccc(OC)c(-c2ccc(C(F)(F)F)cc2CSc2ccccc2)c1

Molecular Processing

Molecular formula
C25H23F3O3S
Molecular weight
460.52
Exact mass
460.132
XLogP
6.78
TPSA
35.53
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
119.77

Supplementary Information

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