PNPLA3 degrader-1
(4-chlorophenyl) (5R)-3,3-difluoro-5-[(5R)-5-methyl-1,1-dioxo-1,2-thiazolidin-2-yl]piperidine-1-carboxylate
Molecular Identity
PNPLA3 degrader-1
(4-chlorophenyl) (5R)-3,3-difluoro-5-[(5R)-5-methyl-1,1-dioxo-1,2-thiazolidin-2-yl]piperidine-1-carboxylate
PubChem CID: 171523990
2D Structure
Properties
C16H19ClF2N2O4S
Molecular Formula
408.80
Molecular Weight
g/mol
408.0722
Exact Mass
Da
3
XLogP
Drug-like (Lipinski: < 5)
75.3
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
7
H-Bond Acceptors
635
Complexity
SMILES
Canonical SMILES
SMILES: CC1CCN(S1(=O)=O)C2CC(CN(C2)C(=O)OC3=CC=C(C=C3)Cl)(F)FIsomeric SMILES
SMILES: C[C@@H]1CCN(S1(=O)=O)[C@@H]2CC(CN(C2)C(=O)OC3=CC=C(C=C3)Cl)(F)FSynonyms(15)
3036158-98-9PF-07853578PNPLA3 degrader-1orb2664203GTPL13839EX-A9586AT48508AC-38339example 11 [O2024084360A1]HY-163959PF07853578T89334(4-chlorophenyl) (5R)-3,3-difluoro-5-[(5R)-5-methyl-1,1-dioxo-1,2-thiazolidin-2-yl]piperidine-1-carboxylate1-Piperidinecarboxylic acid, 3,3-difluoro-5-[(5R)-5-methyl-1,1-dioxido-2-isothiazolidinyl]-, 4-chlorophenyl ester, (5R)-4-chlorophenyl (R)-3,3-difluoro-5-((R)-5-methyl-1,1-dioxidoisothiazolidin-2-yl)piperidine-1-carboxylate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to PNPLA3 degrader-1
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