SMILES:
CS(=O)(=O)c1ccc(C(=NOC2CCCC2)C(=O)Nc2ccon2)cc1ClMolecular Processing
Molecular formula
C17H18ClN3O5S
Molecular weight
411.87
Exact mass
411.0656
XLogP
3.03
TPSA
110.86
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
99.57
Supplementary Information
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