![CAS 1554425-57-8 alpha-Methyl-[1,2,4]triazolo[4,3-a]pyridine-8-methanamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1554425-57-8.gif)
CAS RN: 1554425-57-8
alpha-Methyl-[1,2,4]triazolo[4,3-a]pyridine-8-methanamine
- Product code: SSC-064720
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 |
1554425-57-8 / 1-([1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanamine
Basic Information
CAS
1554425-57-8
Multi CAS
No
Molecular Formula
C8H10N4
Molecular Weight
162.190000
Exact Mass
162.090546
SMILES
CC(C1=CC=CN2C1=NN=C2)N
InChI
InChI=1S/C8H10N4/c1-6(9)7-3-2-4-12-5-10-11-8(7)12/h2-6H,9H2,1H3
InChIKey
FEKLXONBZFVJMZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
45.59
TPSA
56.21
LogP / Solubility
WLOGP
0.75
MLOGP
0.65
XLogP3
0.4
Consensus LogP
0.6
Log S (ESOL)
-1.81
Class (ESOL)
Soluble
Log S (Ali)
-1.43
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
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)
-3.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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