SMILES:
CN(c1ncc(F)s1)C1CCNC1.O=C(O)C(F)(F)FMolecular Processing
Molecular formula
C10H13F4N3O2S
Molecular weight
315.29
Exact mass
315.0665
XLogP
1.71
TPSA
65.46
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.6
Molar refractivity
65.44
Supplementary Information
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