O=C(OC(CO)CO)C1(c2ccc(-c3ccc(Cl)c(Cl)c3)c(F)c2)CC1
SMILES: O=C(OC(CO)CO)C1(c2ccc(-c3ccc(Cl)c(Cl)c3)c(F)c2)CC1

Molecular Processing

Molecular formula
C19H17Cl2FO4
Molecular weight
399.25
Exact mass
398.0488
XLogP
3.73
TPSA
66.76
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
96.82

Supplementary Information

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