SMILES:
CCOC(=O)CN(CC(O)c1csc(C(F)(F)F)n1)C(C)Cc1ccc(OCC(=O)OC)cc1Molecular Processing
Molecular formula
C22H27F3N2O6S
Molecular weight
504.53
Exact mass
504.1542
XLogP
3.24
TPSA
98.19
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
12
Heavy atoms
34
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
117.4
Supplementary Information
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