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CAS 1379324-53-4 5-BroMo-2-(Methylsulfonyl)pyriMidin-4-aMine molecular structure lightbox
CAS RN: 1379324-53-4

5-BroMo-2-(Methylsulfonyl)pyriMidin-4-aMine

Product Availability

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3 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260312 1g Out of stock Inquiry
Batchno.20250126 250mg In stock Shanghai Inquiry
Batchno.20250423 5g Out of stock Inquiry
  • Product code: SSC-047745
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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: 0.25g
  • 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 1379324-53-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

1379324-53-4 / 5-bromo-2-methylsulfonylpyrimidin-4-amine

Standard CAS: 1379324-53-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1379324-53-4
Multi CAS
No
Molecular Formula
C5H6BrN3O2S
Molecular Weight
252.090000
Exact Mass
250.936410
SMILES
CS(=O)(=O)C1=NC=C(C(=N1)N)Br
InChI
InChI=1S/C5H6BrN3O2S/c1-12(10,11)5-8-2-3(6)4(7)9-5/h2H,1H3,(H2,7,8,9)
InChIKey
QMDXZZOONBDILU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
47.25
TPSA
85.94

LogP / Solubility

WLOGP
0.22
MLOGP
0.2
XLogP3
0.1
Consensus LogP
0.17
Log S (ESOL)
-1.85
Class (ESOL)
Soluble
Log S (Ali)
-1.79
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.61
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)
-4.1

Drug-likeness / Medicinal Chemistry

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

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