SMILES:
O=C(O)c1cc(F)c(Oc2cnc(OC3CCOCC3)c(Cl)c2)cc1FMolecular Processing
Molecular formula
C17H14ClF2NO5
Molecular weight
385.75
Exact mass
385.0529
XLogP
4.06
TPSA
77.88
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
87.11
Supplementary Information
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