O=S(=O)(c1ccccc1)C1CC2(c3ccccc3)N(Cc3ccccc3)C1CCC21CC(c2cc(OC(F)(F)F)ccc2OCc2ccccc2)CO1
SMILES: O=S(=O)(c1ccccc1)C1CC2(c3ccccc3)N(Cc3ccccc3)C1CCC21CC(c2cc(OC(F)(F)F)ccc2OCc2ccccc2)CO1

Molecular Processing

Molecular formula
C43H40F3NO5S
Molecular weight
739.86
Exact mass
739.2579
XLogP
9.21
TPSA
65.07
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
53
Rings
8
Aromatic rings
5
Saturated rings
3
Aliphatic rings
3
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.302
Molar refractivity
195.1

Supplementary Information

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