Research chemical
CAS Number: 2736511-76-3
![(R)-4-[1-[3-(tert-Butyl)-1,2,4-oxadiazole-5-carboxamido]ethyl]-3-methylphenylboronic Acid Pinacol Ester molecular structure, CAS 2736511-76-3](/structure-images/2736511-76-3.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
166521973
Exact Mass
413.248587
InChIKey
PBHADEIVJJUXJH-CQSZACIVSA-N
IUPAC Name
3-tert-butyl-N-[(1R)-1-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,2,4-oxadiazole-5-carboxamide
SMILES String
Cc1cc(B2OC(C)(C)C(C)(C)O2)ccc1[C@@H](C)NC(=O)c1nc(C(C)(C)C)no1
No physical property values available.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
(R)-4-[1-[3-(tert-Butyl)-1,2,4-oxadiazole-5-carboxamido]ethyl]-3-methylphenylboronic Acid Pinacol Ester is identified by CAS 2736511-76-3, with molecular formula C22H32BN3O4, molecular weight 413.3, InChIKey PBHADEIVJJUXJH-CQSZACIVSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
30
H-bond acceptors
7
H-bond donors
1
Rotatable bonds
4
Ring count
3
Aromatic rings
2
Topological polar surface area
86.48 Ų
Computed LogP
3.47
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
Yes
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
(R)-4-[1-[3-(tert-Butyl)-1,2,4-oxadiazole-5-carboxamido]ethyl]-3-methylphenylboronic Acid Pinacol Ester (CAS 2736511-76-3) is maintained as a commercial cas reference with formula C22H32BN3O4, molecular weight 413. 30 g/mol, PubChem CID 166521973.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include nitrogen-containing heterocycle, boronic-acid-related structure, drug-like rule profile.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.