Research chemical
3-(4-Acetamidophenyl)-5,6-diphenyl-1,2,4-triazine
CAS Number: 100321-96-8
Product details
Identity & specification
- Molecular formula
- C23H18N4O
- Molecular weight
- 366.4 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
6415496
Exact Mass
366.148061
InChIKey
SFVIFGKNSNVUQM-UHFFFAOYSA-N
IUPAC Name
N-[4-(5,6-diphenyl-1,2,4-triazin-3-yl)phenyl]acetamide
SMILES String
CC(=O)Nc1ccc(-c2nnc(-c3ccccc3)c(-c3ccccc3)n2)cc1
Physical Properties
No physical property values available.
Show more physical data
XLogP
3.4
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
28
H-bond acceptors
5
H-bond donors
1
Rotatable bonds
4
Ring count
4
Aromatic rings
4
Topological polar surface area
67.77 Ų
Computed LogP
4.83
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
3-(4-Acetamidophenyl)-5,6-diphenyl-1,2,4-triazine (CAS 100321-96-8) is listed in the Advanced Chemicals portfolio, with molecular formula C23H18N4O and molecular weight 366. 40 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
Consult the supplier SDS before handling; For research use only.
Applications & Classification
Safety & Handling
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 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 questions
What are the key identifiers for 3-(4-Acetamidophenyl)-5,6-diphenyl-1,2,4-triazine (CAS 100321-96-8)?
3-(4-Acetamidophenyl)-5,6-diphenyl-1,2,4-triazine is identified by CAS 100321-96-8, with molecular formula C23H18N4O, molecular weight 366.4, InChIKey SFVIFGKNSNVUQM-UHFFFAOYSA-N.
Can I request a COA for CAS 100321-96-8?
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Can I request supplier SDS for 3-(4-Acetamidophenyl)-5,6-diphenyl-1,2,4-triazine?
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Is CAS 100321-96-8 available for quotation?
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Can MolGraph support bulk sourcing or custom synthesis review?
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.