SMILES:
O=C(NCC1CCCCC1)c1ccc(C(c2cc(F)ccc2F)S(=O)(=O)c2ccc(Cl)cc2)nc1Molecular Processing
Molecular formula
C26H25ClF2N2O3S
Molecular weight
519.01
Exact mass
518.1242
XLogP
5.89
TPSA
76.13
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
129.98
Supplementary Information
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