![CAS 52559-17-8 6-Chloro-3H-imidazo[4,5-c]pyridin-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52559-17-8.gif)
CAS RN: 52559-17-8
6-Chloro-3H-imidazo[4,5-c]pyridin-4-amine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251126 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS52559-17-8
- Purity/Analytical Methods: >99.0%
52559-17-8 / 6-chloro-1H-imidazo[4,5-c]pyridin-4-amine
Basic Information
CAS
52559-17-8
Multi CAS
No
Molecular Formula
C6H5CLN4
Molecular Weight
168.580000
Exact Mass
168.020274
InChI
InChI=1S/C6H5ClN4/c7-4-1-3-5(6(8)11-4)10-2-9-3/h1-2H,(H2,8,11)(H,9,10)
InChIKey
TTZXYGSHDKSCST-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
3
H-bond donors
2
Molar refractivity
43.31
TPSA
67.59
LogP / Solubility
WLOGP
1.19
MLOGP
1.05
XLogP3
1
Consensus LogP
1.08
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.8
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.75
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)
-2.9
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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