![CAS 1094107-41-1 2-AMino-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid Methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1094107-41-1.gif)
CAS RN: 1094107-41-1
2-AMino-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid Methyl ester
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: SSC-010707
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, 1g, 5g, 10g
- Available purity: >97%
- Inventory rows with stock: 4
- 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.1g | >97% | 1 In Stock | Shanghai | Inquiry |
| 0.25g | >97% | 1 In Stock | Shanghai | Inquiry |
| 1g | >97% | 1 In Stock | Beijing | Inquiry |
| 5g | >97% | 1 In Stock | Hong Kong | Inquiry |
| 10g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
1094107-41-1 / methyl 2-amino-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate
DTXSID50724401 | Methyl 2-amino(1,2,4)triazolo(1,5-a)pyridine-6-carboxylate | Methyl 2-amino[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate
Basic Information
CAS
1094107-41-1
Multi CAS
No
Molecular Formula
C8H8N4O2
Molecular Weight
192.170000
Exact Mass
192.064726
SMILES
COC(=O)C1=CN2C(=NC(=N2)N)C=C1
InChI
InChI=1S/C8H8N4O2/c1-14-7(13)5-2-3-6-10-8(9)11-12(6)4-5/h2-4H,1H3,(H2,9,11)
InChIKey
GSJSEKQHYSMYEF-UHFFFAOYSA-N
Synonyms
DTXSID50724401
Methyl 2-amino(1,2,4)triazolo(1,5-a)pyridine-6-carboxylate
Methyl 2-amino[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate
RefChem:1089318
DTXCID50675146
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
6
H-bond donors
1
Molar refractivity
48.74
TPSA
82.51
LogP / Solubility
WLOGP
0.1
MLOGP
0.09
XLogP3
0.3
Consensus LogP
0.16
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-1.21
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.11
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)
-3.82
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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