SMILES:
O=C1OC(=O)c2nc3c(Cl)csc3cc21Molecular Processing
Molecular formula
C9H2ClNO3S
Molecular weight
239.64
Exact mass
238.9444
XLogP
2.26
TPSA
56.26
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
15
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
54.38
Supplementary Information
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