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CAS 2423-65-6 Pyrazine 1-oxide molecular structure lightbox
CAS RN: 2423-65-6

Pyrazine 1-oxide

  • Product code: SSC-118304
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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 2423-65-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

2423-65-6 / 1-oxidopyrazin-1-ium

Standard CAS: 2423-65-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2423-65-6
Multi CAS
No
Molecular Formula
C4H4N2O
Molecular Weight
96.090000
Exact Mass
96.032363
SMILES
C1=C[N+](=CC=N1)[O-]
InChI
InChI=1S/C4H4N2O/c7-6-3-1-5-2-4-6/h1-4H
InChIKey
RUIZBQQGWNBRFH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
23.2
TPSA
39.83

LogP / Solubility

WLOGP
-0.29
MLOGP
-0.26
XLogP3
-1.2
Consensus LogP
-0.58
Log S (ESOL)
-0.89
Class (ESOL)
Very soluble
Log S (Ali)
-0.14
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.05
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)
-3.51

Drug-likeness / Medicinal Chemistry

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

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