Nombre: scopine di-(2-thienyl)glycolate
SMILES:
CN1[C@@H]2CC(OC(=O)C(O)(c3cccs3)c3cccs3)C[C@H]1[C@@H]1O[C@@H]12Molecular Processing
Molecular formula
C18H19NO4S2
Molecular weight
377.49
Exact mass
377.0756
XLogP
2.2
TPSA
62.3
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
25
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
94.75
Supplementary Information
Obteniendo detalles…
Participa en 7 reacciones→