rel-(1R,5S)-9-benzyl-3-(2-chlorobenzene-1-sulfonyl)-7-ethyl-3,7,9-triazabicyclo[3.3.2]decan-10-one

Chemical Structure Depiction of
rel-(1R,5S)-9-benzyl-3-(2-chlorobenzene-1-sulfonyl)-7-ethyl-3,7,9-triazabicyclo[3.3.2]decan-10-one
Available: 28 mg
Amount:
mg
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Compound characteristics

Compound ID: SD24-0415
Compound Name: rel-(1R,5S)-9-benzyl-3-(2-chlorobenzene-1-sulfonyl)-7-ethyl-3,7,9-triazabicyclo[3.3.2]decan-10-one
Molecular Weight: 447.98
Molecular Formula: C22 H26 Cl N3 O3 S
Smiles: [H][C@]12CN(CC)C[C@]([H])(CN(C1)S(c1ccccc1[Cl])(=O)=O)C(N2Cc1ccccc1)=O
Stereo: RACEMIC MIXTURE (RELATIVE)
logP: 2.4499
logD: 1.8854
logSw: -2.9335
Hydrogen bond acceptors count: 8
Polar surface area: 51.514
InChI Key: ZXPRECQRQXKVNF-MOPGFXCFSA-N
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