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CAS 142946-79-0 4,4′-Bis(trifluoromethyl)-2,2′-bipyridyl molecular structure lightbox
CAS RN: 142946-79-0

4,4′-Bis(trifluoromethyl)-2,2′-bipyridyl

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260220 200mg / 1g / 5g Confirm by inquiry Shanghai, Guangdong Inquiry
  • Product code: SSC-054254
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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: 0.25g, 1g, 5g
  • Available purity: ≥98%
  • 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 142946-79-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥98% 0 Out of Stock Shenzhen Inquiry
1g ≥98% 0 Out of Stock Shanghai Inquiry
5g ≥98% 0 Out of Stock Beijing Inquiry

142946-79-0 / 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine

Standard CAS: 142946-79-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
142946-79-0
Multi CAS
No
Molecular Formula
C12H6F6N2
Molecular Weight
292.180000
Exact Mass
292.043517
SMILES
C1=CN=C(C=C1C(F)(F)F)C2=NC=CC(=C2)C(F)(F)F
InChI
InChI=1S/C12H6F6N2/c13-11(14,15)7-1-3-19-9(5-7)10-6-8(2-4-20-10)12(16,17)18/h1-6H
InChIKey
FFOMEQIMPYKURW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
57.47
TPSA
25.78

LogP / Solubility

WLOGP
4.18
MLOGP
3.69
XLogP3
3.2
Consensus LogP
3.69
Log S (ESOL)
-4.66
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.97
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.15
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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