6-[10-(4-methylphenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]hexanoic acid

Chemical Structure Depiction of
6-[10-(4-methylphenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]hexanoic acid
Available: 195 mg
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mg
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Compound characteristics

Compound ID: D008-0102
Compound Name: 6-[10-(4-methylphenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]hexanoic acid
Molecular Weight: 512.65
Molecular Formula: C26 H28 N2 O5 S2
Smiles: Cc1ccc(cc1)C1C2C3CC(C4C3C(N(CCCCCC(O)=O)C4=O)=O)C2SC2=C1SC(N2)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.2728
logD: 0.4446
logSw: -3.4578
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 2
Polar surface area: 81.682
InChI Key: OTAYLNSGWFNFGL-UHFFFAOYSA-N
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