SMILES:
CCOC(=O)c1c(S)nc2cc(Cl)c(F)cc2c1OMolecular Processing
Molecular formula
C12H9ClFNO3S
Molecular weight
301.73
Exact mass
300.9976
XLogP
3.2
TPSA
59.42
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
71.58
Supplementary Information
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