Nombre: methyl 2-(4-(3-chloropropylsulfonamido)phenyl)-2-methoxyacetate
SMILES:
COC(=O)C(OC)c1ccc(NS(=O)(=O)CCCCl)cc1Molecular Processing
Molecular formula
C13H18ClNO5S
Molecular weight
335.81
Exact mass
335.0594
XLogP
1.92
TPSA
81.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
80.95
Supplementary Information
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