Название: racemic (2′R,3R,4′S)-6-chloro-2′-(2-chlorophenyl)-4′-(3-chlorophenyl)-2,3-dihydro-2,6′-dioxospiro[indole-3,3′-piperidine]-1-carboxylic acid ethyl ester
SMILES:
CCOC(=O)N1C(=O)C2(c3ccc(Cl)cc31)C(c1cccc(Cl)c1)CC(=O)NC2c1ccccc1ClMolecular Processing
Molecular formula
C27H21Cl3N2O4
Molecular weight
543.83
Exact mass
542.0567
XLogP
6.43
TPSA
75.71
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
138.78
Supplementary Information
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