이름: N-(4-methanesulfonylamino-2-sulfamoyl-phenyl)-malonamic acid methyl ester
SMILES:
COC(=O)CC(=O)Nc1ccc(NS(C)(=O)=O)cc1S(N)(=O)=OMolecular Processing
Molecular formula
C11H15N3O7S2
Molecular weight
365.39
Exact mass
365.0351
XLogP
-0.79
TPSA
161.73
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
81.54
Supplementary Information
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