Research chemical
Idelalisib
CAS Number: 870281-82-6
Product details
Identity & specification
- Molecular formula
- C22H18FN7O
- Molecular weight
- 415.4 g/mol
- Product type
- Research-use catalog compound
- Documentation
- COA / SDS available by request
For laboratory research and professional procurement workflows.
Technical identifiers
Show PubChem, InChIKey, IUPAC, and SMILES
PubChem CID
11625818
Exact Mass
415.155686
InChIKey
IFSDAJWBUCMOAH-HNNXBMFYSA-N
IUPAC Name
5-fluoro-3-phenyl-2-[(1S)-1-(7H-purin-6-ylamino)propyl]quinazolin-4-one
SMILES String
CC[C@@H](C1=NC2=C(C(=CC=C2)F)C(=O)N1C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5
Physical Properties
Appearance
White to off-white powder
Water Solubility
0.1 mol/L
Show more physical data
XLogP
3.7
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Computed Structure Descriptors
Show calculated structure fields
Heavy atom count
31
H-bond acceptors
8
H-bond donors
2
Rotatable bonds
5
Ring count
5
Aromatic rings
5
Topological polar surface area
101.38 Ų
Computed LogP
3.75
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
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.
Catalog Facts
Structural features
Idelalisib (CAS 870281-82-6) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C22H18FN7O and molecular weight 415. 40 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research-stage medicinal chemistry and intermediate synthesis workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
SDS signal word: Warning; hazard codes: H302, H315, H319, H335; For research use only.
Applications & Classification
Biological target reference
ChEMBL reports experimental activity evidence for: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens) — 56 assays; PI3-kinase p110-delta/p85-alpha (Homo sapiens) — 11 assays; Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens) — 36 assays; Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens) — 28 assays; Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens) — 25 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
Homo sapiens · SINGLE PROTEIN · 56 qualifying assays · 45 documents · best pChEMBL 9
Experimental evidence source: ChEMBL
PI3-kinase p110-delta/p85-alpha
Homo sapiens · PROTEIN COMPLEX · 11 qualifying assays · 9 documents · best pChEMBL 8.97
Experimental evidence source: ChEMBL
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
Homo sapiens · SINGLE PROTEIN · 36 qualifying assays · 33 documents · best pChEMBL 7.6
Experimental evidence source: ChEMBL
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
Homo sapiens · SINGLE PROTEIN · 28 qualifying assays · 26 documents · best pChEMBL 7.2
Experimental evidence source: ChEMBL
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
Homo sapiens · SINGLE PROTEIN · 25 qualifying assays · 23 documents · best pChEMBL 6.87
Experimental evidence source: ChEMBL
Safety & Handling
Handling & Storage
- Keep container tightly closed and dry.
- Store in a well-ventilated place.
- Avoid contact with skin and eyes.
PPE
First Aid
- Do not give anything to an unconscious person.
- Rinse mouth with water.
Stability / Reactivity
- Reactivity and stability.
- Carbon monoxide, carbon dioxide, hydrogen fluoride, nitrogen oxides.
Disposal
- The product Remaining and non-recyclable solutions should be handed over to a licensed company for disposal.
- Contact a professional agency with a waste disposal license to handle this substance.
Show additional safety reference fields
Fire Fighting
- If necessary, wear a self-contained breathing apparatus for firefighting.
Accidental Release
- Do not generate dust when collecting and disposing.
- Sweep and shovel up.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS RequestCatalog navigation
Related Catalog Entries
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Procurement notes
Sourcing context and documentation notes
Show details
Procurement notes
Sourcing context and documentation notes
MolGraph uses public price and availability evidence as a starting point, then confirms current stock, quotation, COA/SDS, lot specification, lead time, and shipment documentation before final acceptance.
Package and specification
Use the quote panel for visible public options. Additional quantities or specifications can be reviewed by RFQ.
Final lot confirmation
Purity, lot identity, and batch-specific documentation are confirmed before procurement decisions.
Supply documentation
Supplier-issued COA and SDS can be requested before handling, storage, shipment, or procurement decisions.
Quotation review
Final quote depends on quantity, lead time, destination, and supplier confirmation.
Procurement questions
Is CAS 870281-82-6 in stock?
Idelalisib is in stock. Estimated delivery: 5–9 business days. Submit an RFQ to confirm final price, lot specification, documentation, and destination-specific shipping terms.
How is the final price confirmed?
The page shows a public reference price in the quote panel. Submit an RFQ to confirm current price, quantity breaks, lead time, and destination-specific shipping requirements.
Can MolGraph provide COA or SDS for CAS 870281-82-6?
Yes. Supplier-issued COA and SDS can be requested during the RFQ workflow. Lot-specific documents depend on supplier and batch confirmation.