SMILES:
Cl.N[C@@H]1C(=O)N2C(C(=O)OCc3ccccc3)=CC(=O)S[C@H]12Molecular Processing
Molecular formula
C14H13ClN2O4S
Molecular weight
340.79
Exact mass
340.0285
XLogP
0.8
TPSA
89.7
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.214
Molar refractivity
82.78
Supplementary Information
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