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CAS 887352-34-3 2-Amino-3-bromopyrazine-5-carboxylic Acid molecular structure lightbox
CAS RN: 887352-34-3

2-Amino-3-bromopyrazine-5-carboxylic Acid

  • Product code: SSC-200253
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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 887352-34-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

887352-34-3 / 5-amino-6-bromopyrazine-2-carboxylic acid

Standard CAS: 887352-34-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
887352-34-3
Multi CAS
No
Molecular Formula
BC5H4O2Rn3
Molecular Weight
218.010000
Exact Mass
216.948690
InChI
InChI=1S/C5H4BrN3O2/c6-3-4(7)8-1-2(9-3)5(10)11/h1H,(H2,7,8)(H,10,11)
InChIKey
ZWJHDIXBWPBYGD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
41.1
TPSA
89.1

LogP / Solubility

WLOGP
0.52
MLOGP
0.46
XLogP3
0.3
Consensus LogP
0.43
Log S (ESOL)
-1.86
Class (ESOL)
Soluble
Log S (Ali)
-1.72
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.63
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.68

Drug-likeness / Medicinal Chemistry

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

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