![CAS 1019026-04-0 8-fluoro-[1,2,4]triazolo[4,3-a]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1019026-04-0.gif)
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
1019026-04-0 / 8-fluoro-[1,2,4]triazolo[4,3-a]pyridine
8-fluoro-[1,2,4]triazolo[4,3-a]pyridine | MFCD09994438 | SCHEMBL16402571
Basic Information
CAS
1019026-04-0
Multi CAS
No
Molecular Formula
C6H4FN3
Molecular Weight
137.110000
Exact Mass
137.038925
SMILES
C1=CN2C=NN=C2C(=C1)F
InChI
InChI=1S/C6H4FN3/c7-5-2-1-3-10-4-8-9-6(5)10/h1-4H
InChIKey
GVXGQKXEILGHFD-UHFFFAOYSA-N
Synonyms
8-fluoro-[1,2,4]triazolo[4,3-a]pyridine
MFCD09994438
SCHEMBL16402571
UQB02604
AKOS006313863
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
3
Molar refractivity
32.95
TPSA
30.19
LogP / Solubility
WLOGP
0.87
MLOGP
0.76
XLogP3
1.3
Consensus LogP
0.98
Log S (ESOL)
-1.9
Class (ESOL)
Soluble
Log S (Ali)
-1.31
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.27
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)
-2.94
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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