SMILES:
O=C(NOCCO)c1ccc(F)c(F)c1Nc1ccc(C#CCCOC2CCCCO2)cc1FMolecular Processing
Molecular formula
C24H25F3N2O5
Molecular weight
478.47
Exact mass
478.1716
XLogP
3.79
TPSA
89.05
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
34
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
117.58
Supplementary Information
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