CC(C)CC(NS(=O)(=O)Cc1ccccc1)C(=O)O
SMILES: CC(C)CC(NS(=O)(=O)Cc1ccccc1)C(=O)O

Molecular Processing

Molecular formula
C13H19NO4S
Molecular weight
285.37
Exact mass
285.1035
XLogP
1.61
TPSA
83.47
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
73.08

Supplementary Information

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