Nom: 3-{2-[(5-hydroxymethyl-1H-imidazol-4-yl)methylthio]ethylamino}-4-methoxy-1,2,5-thiadiazole 1,1-dioxide
SMILES:
COC1=NS(=O)(=O)N=C1NCCSCc1nc[nH]c1COMolecular Processing
Molecular formula
C10H15N5O4S2
Molecular weight
333.4
Exact mass
333.0565
XLogP
-0.57
TPSA
129.03
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
79.47
Supplementary Information
Récupération des détails…
Impliqué dans 5 réactions→