Name: Intermediate 25
SMILES:
CC1CCCCN1c1ccc(C(=O)O)cc1NS(C)(=O)=OMolecular Processing
Molecular formula
C14H20N2O4S
Molecular weight
312.39
Exact mass
312.1144
XLogP
2.14
TPSA
86.71
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
82.53
Supplementary Information
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