Nombre: 2-(3,4- diethoxyphenyl)-4-(3-nonyloxycarbonyl-4-methoxymethoxyphenyl)thiazole
SMILES:
CCCCCCCCCOC(=O)c1cc(-c2csc(-c3ccc(OCC)c(OCC)c3)n2)ccc1OCOCMolecular Processing
Molecular formula
C31H41NO6S
Molecular weight
555.74
Exact mass
555.2655
XLogP
8.16
TPSA
76.11
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
18
Heavy atoms
39
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
0.484
Molar refractivity
156.1
Supplementary Information
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