SMILES:
CC(C)(C)OC(=O)Nc1sc(-c2cncc(F)c2)nc1FMolecular Processing
Molecular formula
C13H13F2N3O2S
Molecular weight
313.33
Exact mass
313.0697
XLogP
3.83
TPSA
64.11
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
75.12
Supplementary Information
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