CC1(C)NC(=O)N(c2ccc(SC(F)(F)F)c([N+](=O)[O-])c2)C1=O
SMILES: CC1(C)NC(=O)N(c2ccc(SC(F)(F)F)c([N+](=O)[O-])c2)C1=O

Molecular Processing

Molecular formula
C12H10F3N3O4S
Molecular weight
349.29
Exact mass
349.0344
XLogP
3.04
TPSA
92.55
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
75.11

Supplementary Information

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