الاسم: 5-{4-[2-(3-phenyl-2-hydroxypropylamino)propoxy]benzyl}thiazolidine-2,4-dione
SMILES:
CC(COc1ccc(CC2SC(=O)NC2=O)cc1)NCC(O)Cc1ccccc1Molecular Processing
Molecular formula
C22H26N2O4S
Molecular weight
414.53
Exact mass
414.1613
XLogP
2.54
TPSA
87.66
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
114.18
Supplementary Information
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