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CAS 3562-84-3 Benzbromarone molecular structure lightbox
CAS RN: 3562-84-3

Benzbromarone

Product Availability

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12 package records11 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251107 10g Out of stock Inquiry
Batchno.20260426 1g In stock Inquiry
Batchno.20250212 25g In stock Inquiry
Batchno.20251121 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260322 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250814 100g In stock Shanghai Inquiry
Batchno.20250207 10g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250222 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251119 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251227 25g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20250414 5g In stock Shanghai, Tianjin, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251202 1g In stock Inquiry
  • Product code: SSC-142649
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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 3562-84-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

3562-84-3 / (3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-1-benzofuran-3-yl)methanone

Standard CAS: 3562-84-3 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
3562-84-3
Multi CAS
No
Molecular Formula
C17H12BR2O3
Molecular Weight
424.100000
Exact Mass
423.913270
InChI
InChI=1S/C17H12Br2O3/c1-2-13-15(10-5-3-4-6-14(10)22-13)16(20)9-7-11(18)17(21)12(19)8-9/h3-8,21H,2H2,1H3
InChIKey
WHQCHUCQKNIQEC-UHFFFAOYSA-N

Physical Properties

Melting Point
151 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
15
Fraction Csp3
0.12
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
92.53
TPSA
50.44

LogP / Solubility

WLOGP
5.46
MLOGP
4.83
XLogP3
5.7
Consensus LogP
5.33
Log S (ESOL)
-6.21
Class (ESOL)
Insoluble
Log S (Ali)
-6.98
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.31
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.43

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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