SMILES:
N#CC(OC(=O)C1(c2ccc(OC(F)(F)F)cc2)CC1(Cl)Cl)c1ccc(F)c(Oc2ccccc2)c1Molecular Processing
Molecular formula
C25H15Cl2F4NO4
Molecular weight
540.3
Exact mass
539.0314
XLogP
7.14
TPSA
68.55
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
121.22
Supplementary Information
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