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CAS 34550-49-7 7-Chloro-3H-[1,2,3]triazolo[4,5-b]pyridine molecular structure lightbox
CAS RN: 34550-49-7

7-Chloro-3H-[1,2,3]triazolo[4,5-b]pyridine

  • Product code: SSC-141022
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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: ＞97%
  • 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 34550-49-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

34550-49-7 / 7-chloro-2H-triazolo[4,5-b]pyridine

Standard CAS: 34550-49-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
34550-49-7
Multi CAS
No
Molecular Formula
C5H3CLN4
Molecular Weight
154.560000
Exact Mass
154.004624
InChI
InChI=1S/C5H3ClN4/c6-3-1-2-7-5-4(3)8-10-9-5/h1-2H,(H,7,8,9,10)
InChIKey
TUZJXUVABAFXDG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
3
H-bond donors
1
Molar refractivity
36.69
TPSA
54.46

LogP / Solubility

WLOGP
1.01
MLOGP
0.88
XLogP3
0.9
Consensus LogP
0.93
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.55
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.5
Class (SILICOS-IT)
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)
-2.95

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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