SMILES:
COc1ccc(-c2nc(CSCCO)nc3cc(OC)c(OC)cc23)cc1OCMolecular Processing
Molecular formula
C21H24N2O5S
Molecular weight
416.5
Exact mass
416.1406
XLogP
3.56
TPSA
82.93
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
114.43
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→