CC(C)(O)c1cc(F)c(-c2nc(C(N)=O)c(Nc3ccc(C(C)(C)O)nn3)s2)c(F)c1
SMILES: CC(C)(O)c1cc(F)c(-c2nc(C(N)=O)c(Nc3ccc(C(C)(C)O)nn3)s2)c(F)c1

Molecular Processing

Molecular formula
C20H21F2N5O3S
Molecular weight
449.48
Exact mass
449.1333
XLogP
3.18
TPSA
134.25
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
111.79

Supplementary Information

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