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CAS 5417-78-7 4-AMINO-6-CHLORO-PYRAZOLO[3,4-D]PYRIMIDINE molecular structure lightbox
CAS RN: 5417-78-7

4-AMINO-6-CHLORO-PYRAZOLO[3,4-D]PYRIMIDINE

Product Availability

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8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260621 1g In stock Inquiry
Batchno.20250220 250mg In stock Inquiry
Batchno.20250607 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250124 100mg In stock Shanghai Inquiry
Batchno.20260330 10g In stock Shanghai Inquiry
Batchno.20260224 1g In stock Shanghai Inquiry
Batchno.20251125 250mg In stock Shanghai Inquiry
Batchno.20260630 5g In stock Shanghai Inquiry
  • Product code: SSC-161768
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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 5417-78-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

5417-78-7 / 6-chloro-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Standard CAS: 5417-78-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5417-78-7
Multi CAS
Yes
Molecular Formula
C5H4CLN5
Molecular Weight
169.570000
Exact Mass
169.015523
InChI
InChI=1S/C5H4ClN5/c6-5-9-3(7)2-1-8-11-4(2)10-5/h1H,(H3,7,8,9,10,11)
InChIKey
BRZGPZOZVWMCDL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
4
H-bond donors
2
Molar refractivity
41.11
TPSA
80.48

LogP / Solubility

WLOGP
0.59
MLOGP
0.51
XLogP3
0.8
Consensus LogP
0.63
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.25
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)
-3.34

Drug-likeness / Medicinal Chemistry

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

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