Research chemical
CAS Number: 117067-47-7
![N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]benzamide molecular structure, CAS 117067-47-7](/structure-images/117067-47-7.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
3286884
Exact Mass
294.148061
InChIKey
MQHUHBAQFGATRB-UHFFFAOYSA-N
IUPAC Name
N-[1-(benzotriazol-1-yl)butyl]benzamide
SMILES String
CCCC(NC(=O)c1ccccc1)n1nnc2ccccc21
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
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.
N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]benzamide is identified by CAS 117067-47-7, with molecular formula C17H18N4O, molecular weight 294.35, InChIKey MQHUHBAQFGATRB-UHFFFAOYSA-N.
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.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
22
H-bond acceptors
5
H-bond donors
1
Rotatable bonds
5
Ring count
3
Aromatic rings
3
Topological polar surface area
59.81 Ų
Computed LogP
3.16
Fragment-like structure rule
Yes
Lead-like structure rule
Yes
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.
Structural features
N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]benzamide (CAS 117067-47-7) is maintained as a cataloged research chemical with formula C17H18N4O, molecular weight 294. 35 g/mol, PubChem CID 3286884.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for identity verification, supplier-aware sourcing review, and RFQ preparation; structure-derived tags include nitrogen-containing heterocycle, fragment-like structure profile, lead-like structure profile, drug-like rule profile.
Documentation needs
SDS signal word: Warning; hazard codes: H302, H315, H319, H335; 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.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS Request