Nom: 1-benzyl 4-methyl(2S)-2-[benzyl((2R)-2-(1-ethoxyethoxy)-3-[(4-methylphenyl)sulfonyl]oxypropyl)amino]succinate
SMILES:
CCOC(C)O[C@@H](COS(=O)(=O)c1ccc(C)cc1)CN(Cc1ccccc1)[C@@H](CC(=O)OC)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C33H41NO9S
Molecular weight
627.76
Exact mass
627.2502
XLogP
4.65
TPSA
117.67
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
18
Heavy atoms
44
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.394
Molar refractivity
163.79
Supplementary Information
Récupération des détails…
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