![CAS 1245647-62-4 5-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1245647-62-4.gif)
CAS RN: 1245647-62-4
5-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
- Product code: SSC-028476
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: 0.1g, 0.25g
- Available purity: ≥95%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
1245647-62-4 / 5-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
Basic Information
CAS
1245647-62-4
Multi CAS
No
Molecular Formula
C6H5FN4
Molecular Weight
152.130000
Exact Mass
152.049824
SMILES
C1=CC2=NC(=NN2C(=C1)F)N
InChI
InChI=1S/C6H5FN4/c7-4-2-1-3-5-9-6(8)10-11(4)5/h1-3H,(H2,8,10)
InChIKey
AZYWKGMQTJBPBN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
4
H-bond donors
1
Molar refractivity
37.36
TPSA
56.21
LogP / Solubility
WLOGP
0.45
MLOGP
0.39
XLogP3
0.8
Consensus LogP
0.55
Log S (ESOL)
-1.67
Class (ESOL)
Soluble
Log S (Ali)
-1.13
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.02
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)
-3.33
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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