SMILES:
O=C(O)C(F)(F)F.O=S(=O)(c1ccccc1)n1cc(Cl)c2c3c(ccc21)OCCNC3Molecular Processing
Molecular formula
C19H16ClF3N2O5S
Molecular weight
476.86
Exact mass
476.0421
XLogP
3.65
TPSA
97.63
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
2
Fraction Csp3
0.211
Molar refractivity
106.87
Supplementary Information
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