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CAS 1211584-50-7 5-FLUOROPYRAZINE-2-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 1211584-50-7

5-FLUOROPYRAZINE-2-CARBOXYLIC ACID

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251020 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-022830
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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: 1g
  • 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 1211584-50-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Shenzhen Inquiry

1211584-50-7 / 5-fluoropyrazine-2-carboxylic acid

5-fluoropyrazine-2-carboxylic acid | MFCD18073159 | 5-fluoropyrazine-2-carboxylicacid

Standard CAS: 1211584-50-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1211584-50-7
Multi CAS
No
Molecular Formula
C5H3FN2O2
Molecular Weight
142.090000
Exact Mass
142.017856
SMILES
C1=C(N=CC(=N1)F)C(=O)O
InChI
InChI=1S/C5H3FN2O2/c6-4-2-7-3(1-8-4)5(9)10/h1-2H,(H,9,10)
InChIKey
PVJHQFMTUXTQNZ-UHFFFAOYSA-N
Synonyms
5-fluoropyrazine-2-carboxylic acid MFCD18073159 5-fluoropyrazine-2-carboxylicacid SCHEMBL5224900 SCHEMBL31515463

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
28.95
TPSA
63.08

LogP / Solubility

WLOGP
0.31
MLOGP
0.27
XLogP3
0.1
Consensus LogP
0.23
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-0.95
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.96
Class (SILICOS-IT)
Very 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)
-3.36

Drug-likeness / Medicinal Chemistry

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

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