SMILES:
CC(COCCCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)=NOC(=O)c1ccc(C(F)(F)F)cc1Molecular Processing
Molecular formula
C25H24Cl4F3NO5
Molecular weight
617.28
Exact mass
615.0361
XLogP
8.51
TPSA
66.35
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
14
Heavy atoms
38
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
141.88
Supplementary Information
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