CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCOCC(F)(F)F)cc2)C(OCc2ccc3c(c2)N(CCCOS(C)(=O)=O)CCC3)C1
SMILES: CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCOCC(F)(F)F)cc2)C(OCc2ccc3c(c2)N(CCCOS(C)(=O)=O)CCC3)C1

Molecular Processing

Molecular formula
C35H49F3N2O8S
Molecular weight
714.84
Exact mass
714.3162
XLogP
6.46
TPSA
103.84
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
15
Heavy atoms
49
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.629
Molar refractivity
179.56

Supplementary Information

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