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CAS 1214344-15-6 2,6-DIBROMO-4-FLUOROPYRIDINE molecular structure lightbox
CAS RN: 1214344-15-6

2,6-DIBROMO-4-FLUOROPYRIDINE

  • Product code: SSC-023724
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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: ≥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 1214344-15-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

1214344-15-6 / 2,6-dibromo-4-fluoropyridine

Standard CAS: 1214344-15-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1214344-15-6
Multi CAS
No
Molecular Formula
C5H2Br2FN
Molecular Weight
254.880000
Exact Mass
254.851750
SMILES
C1=C(C=C(N=C1Br)Br)F
InChI
InChI=1S/C5H2Br2FN/c6-4-1-3(8)2-5(7)9-4/h1-2H
InChIKey
VMKXRAUUPMNAOQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
39.6
TPSA
12.89

LogP / Solubility

WLOGP
2.75
MLOGP
2.42
XLogP3
3
Consensus LogP
2.72
Log S (ESOL)
-3.64
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.63
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.6
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.33

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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