SMILES:
O=C(C=Cc1ccc(F)cc1)N1CCN2C(=O)OC(c3ccccc3)(c3ccccc3)C2C1Molecular Processing
Molecular formula
C27H23FN2O3
Molecular weight
442.49
Exact mass
442.1693
XLogP
4.45
TPSA
49.85
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.185
Molar refractivity
122.65
Supplementary Information
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