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CAS 1185428-32-3 2-BroMo-5H-pyrrolo[2,3-b]pyrazine-7-carboxaldehyde molecular structure lightbox
CAS RN: 1185428-32-3

2-BroMo-5H-pyrrolo[2,3-b]pyrazine-7-carboxaldehyde

Product Availability

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6 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250712 100mg / 250mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250705 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260125 10g Out of stock Inquiry
Batchno.20250731 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250818 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250926 5g Out of stock Inquiry
  • Product code: SSC-018399
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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 1185428-32-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1185428-32-3 / 2-bromo-5H-pyrrolo[2,3-b]pyrazine-7-carbaldehyde

2-BROMO-5H-PYRROLO[2,3-B]PYRAZINE-7-CARBALDEHYDE | DTXSID90726984 | 2-Bromo-5H-pyrrolo(2,3-b)pyrazine-7-carbaldehyde

Standard CAS: 1185428-32-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1185428-32-3
Multi CAS
No
Molecular Formula
C7H4BrN3O
Molecular Weight
226.030000
Exact Mass
224.953770
SMILES
C1=C(C2=NC(=CN=C2N1)Br)C=O
InChI
InChI=1S/C7H4BrN3O/c8-5-2-10-7-6(11-5)4(3-12)1-9-7/h1-3H,(H,9,10)
InChIKey
KTQCGYNMGWTOHT-UHFFFAOYSA-N
Synonyms
2-BROMO-5H-PYRROLO[2,3-B]PYRAZINE-7-CARBALDEHYDE DTXSID90726984 2-Bromo-5H-pyrrolo(2,3-b)pyrazine-7-carbaldehyde RefChem:257412 DTXCID70677728

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
46.98
TPSA
58.64

LogP / Solubility

WLOGP
1.53
MLOGP
1.35
XLogP3
0.8
Consensus LogP
1.23
Log S (ESOL)
-2.7
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.52
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.52
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.01

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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