![CAS 886363-57-1 ethyl 6-bromo-3-iodoimidazo[1,2-a]pyridine-2-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/886363-57-1.gif)
CAS RN: 886363-57-1
ethyl 6-bromo-3-iodoimidazo[1,2-a]pyridine-2-carboxylate
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.20250727 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS886363-57-1
- Purity/Analytical Methods: >99.0%
886363-57-1 / ethyl 6-bromo-3-iodoimidazo[1,2-a]pyridine-2-carboxylate
Basic Information
CAS
886363-57-1
Multi CAS
No
Molecular Formula
C10H8BRIN2O2
Molecular Weight
394.990000
Exact Mass
393.881390
InChI
InChI=1S/C10H8BrIN2O2/c1-2-16-10(15)8-9(12)14-5-6(11)3-4-7(14)13-8/h3-5H,2H2,1H3
InChIKey
ZNDGVQIUEUNAAO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
9
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
71.57
TPSA
43.6
LogP / Solubility
WLOGP
2.88
MLOGP
2.56
XLogP3
3.7
Consensus LogP
3.05
Log S (ESOL)
-4.39
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.88
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.86
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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