Research chemical
CAS Number: 1008020-33-4
Product details
For laboratory research and professional procurement workflows.
PubChem CID
1548887
Exact Mass
356.088244
InChIKey
MLKXDPUZXIRXEP-MFOYZWKCSA-N
IUPAC Name
2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetic acid
SMILES String
CC1=C(CC(=O)O)c2cc(F)ccc2/C1=C\c1ccc(S(C)=O)cc1
No physical property values available.
Catalog navigation
Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.
Sulindac is identified by CAS 1008020-33-4, with molecular formula C20H17FO3S, molecular weight 356.4, InChIKey MLKXDPUZXIRXEP-MFOYZWKCSA-N.
ChEMBL contains qualifying experimental assay evidence associated with Cytochrome P450 2C19, Aldo-keto reductase family 1 member B1, Glycine receptor subunit alpha-1, Complement C5, Cytochrome P450 3A4. These records do not establish therapeutic efficacy or clinical use.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
XLogP
3.4
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
25
H-bond acceptors
3
H-bond donors
1
Rotatable bonds
4
Ring count
3
Aromatic rings
2
Topological polar surface area
54.37 Ų
Computed LogP
4.37
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
Sulindac (CAS 1008020-33-4) is an English MolGraph catalog reference, molecular formula C20H17FO3S and molecular weight 356. 40 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page to review identity data, application tags, sourcing readiness, and RFQ context for catalysis and ligand research, bioactivity screening workflows, research chemical sourcing.
Documentation needs
Request supplier-issued SDS/COA before handling, storage, shipment, or procurement decisions. Public page content is for research catalog reference and does not replace supplier-issued safety documentation.
ChEMBL reports experimental activity evidence for: Cytochrome P450 2C19 (Homo sapiens) — 2 assays; Aldo-keto reductase family 1 member B1 (Homo sapiens) — 2 assays; Glycine receptor subunit alpha-1 (Homo sapiens) — 3 assays; Complement C5 (Homo sapiens) — 3 assays; Cytochrome P450 3A4 (Homo sapiens) — 3 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.
Cytochrome P450 2C19
Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 6.7
Experimental evidence source: ChEMBL
Aldo-keto reductase family 1 member B1
Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 2 documents · best pChEMBL 6.68
Experimental evidence source: ChEMBL
Glycine receptor subunit alpha-1
Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 6.42
Experimental evidence source: ChEMBL
Complement C5
Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 6.24
Experimental evidence source: ChEMBL
Cytochrome P450 3A4
Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 6.2
Experimental evidence source: ChEMBL
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.