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CAS 108295-45-0 2,2′:6′,2”-TERPYRIDINE-4′-CARBALDEHYDE molecular structure lightbox
CAS RN: 108295-45-0

2,2′:6′,2”-TERPYRIDINE-4′-CARBALDEHYDE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260522 1g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20260225 250mg In stock Shanghai, Shandong Inquiry
Batchno.20251105 25g Out of stock 5-7 business days Inquiry
Batchno.20260527 5g In stock Shanghai, Chongqing Inquiry
  • Product code: SSC-009623
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 108295-45-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

108295-45-0 / 2,6-dipyridin-2-ylpyridine-4-carbaldehyde

[2,2':6',2''-terpyridine]-4'-carbaldehyde | [2,2':6',2''-Terpyridine]-4'-carboxaldehyde | 2,6-dipyridin-2-ylpyridine-4-carbaldehyde

Standard CAS: 108295-45-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
108295-45-0
Multi CAS
Yes
Molecular Formula
C16H11N3O
Molecular Weight
261.280000
Exact Mass
261.090212
SMILES
C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C=O
InChI
InChI=1S/C16H11N3O/c20-11-12-9-15(13-5-1-3-7-17-13)19-16(10-12)14-6-2-4-8-18-14/h1-11H
InChIKey
MEMKUPMTILFZQJ-UHFFFAOYSA-N
Synonyms
[2,2':6',2''-terpyridine]-4'-carbaldehyde [2,2':6',2''-Terpyridine]-4'-carboxaldehyde 2,6-dipyridin-2-ylpyridine-4-carbaldehyde MFCD06796962 2,2':6',2''-TERPYRIDINE-4'-CARBALDEHYDE

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
18
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
76.09
TPSA
55.74

LogP / Solubility

WLOGP
3.02
MLOGP
2.66
XLogP3
1.8
Consensus LogP
2.49
Log S (ESOL)
-3.83
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.88
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.22
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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