O=S(=O)(c1ccc(Cl)cc1)N1[C@H](CO)Cc2[nH]ncc2[C@@H]1CO
SMILES: O=S(=O)(c1ccc(Cl)cc1)N1[C@H](CO)Cc2[nH]ncc2[C@@H]1CO

Molecular Processing

Molecular formula
C14H16ClN3O4S
Molecular weight
357.82
Exact mass
357.055
XLogP
0.7
TPSA
106.52
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
83.47

Supplementary Information

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