Research chemical
CAS Number: 338410-09-6
![2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl}-N-(2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}ethyl)-2-oxoacetamide molecular structure, CAS 338410-09-6](/structure-images/338410-09-6.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
3489658
Exact Mass
658.108548
InChIKey
ISIFCHUSUIVSEI-UHFFFAOYSA-N
IUPAC Name
2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]indol-3-yl]-N-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethyl]-2-oxoacetamide
SMILES String
O=C(NCCN1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)C(=O)c1cn(-c2ncc(C(F)(F)F)cc2Cl)c2ccccc12
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.
2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl}-N-(2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}ethyl)-2-oxoacetamide is identified by CAS 338410-09-6, with molecular formula C28H22Cl2F6N6O2, molecular weight 659.4, InChIKey ISIFCHUSUIVSEI-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Ordering
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Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
44
H-bond acceptors
8
H-bond donors
1
Rotatable bonds
7
Ring count
5
Aromatic rings
4
Topological polar surface area
83.36 Ų
Computed LogP
5.89
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
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
2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl}-N-(2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}ethyl)-2-oxoacetamide (CAS 338410-09-6) is maintained as a commercial cas reference with formula C28H22Cl2F6N6O2, molecular weight 659.
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.
Documentation needs
Review supplier documentation before handling; for research use only.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.