COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1ncccn1
SMILES: COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1ncccn1

Molecular Processing

Molecular formula
C13H12N4O5S
Molecular weight
336.33
Exact mass
336.0528
XLogP
0.77
TPSA
127.35
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
79.15

Supplementary Information

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