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CAS 31169-25-2 7-BROMOTHIENO[3,2-D]PYRIMIDIN-4(1H)-ONE molecular structure lightbox
CAS RN: 31169-25-2

7-BROMOTHIENO[3,2-D]PYRIMIDIN-4(1H)-ONE

Product Availability

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4 package records1 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250525 1g Out of stock Inquiry
Batchno.20260113 200mg In stock Inquiry
Batchno.20251028 250mg Out of stock Inquiry
Batchno.20250208 250mg / 1g / 5g / 25g Out of stock 8-10 business days Inquiry
  • Product code: SSC-136428
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 0.1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 31169-25-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >95% 3 In Stock Shanghai Inquiry
1g >95% 3 In Stock Beijing Inquiry
0.1g >95% 0 Out of Stock Shenzhen Inquiry
5g >95% 0 Out of Stock Hong Kong Inquiry

31169-25-2 / 7-bromo-4aH-thieno[3,2-d]pyrimidin-4-one

Standard CAS: 31169-25-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
31169-25-2
Multi CAS
Yes
Molecular Formula
BC6H3ORn2S
Molecular Weight
231.070000
Exact Mass
229.914950
InChI
InChI=1S/C6H3BrN2OS/c7-3-1-11-5-4(3)8-2-9-6(5)10/h1-2H,(H,8,9,10)
InChIKey
SFFNZDXKMOSLNK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.17
H-bond acceptors
3
Molar refractivity
49.32
TPSA
41.79

LogP / Solubility

WLOGP
1.35
MLOGP
1.19
XLogP3
1.2
Consensus LogP
1.25
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.28
Class (SILICOS-IT)
Moderately 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)
-3.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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