Nom: Pyrrolidine-1,2-dicarboxylic acid 2-{2-[7-(2-bromo-acetyl)-dibenzofuran-3-yl]-2-oxo-ethyl}ester 1-tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)c1ccc2c(c1)oc1cc(C(=O)CBr)ccc12Molecular Processing
Molecular formula
C26H26BrNO7
Molecular weight
544.4
Exact mass
543.0893
XLogP
5.29
TPSA
103.12
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
133.1
Supplementary Information
Récupération des détails…
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