![CAS 1044733-65-4 3-(6-BROMOPYRIDIN-2-YL)-6-CHLOROIMIDAZO[1,2-A]PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1044733-65-4.gif)
CAS RN: 1044733-65-4
3-(6-BROMOPYRIDIN-2-YL)-6-CHLOROIMIDAZO[1,2-A]PYRIDINE
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.20260110 | 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1044733-65-4
- Purity/Analytical Methods: >99.0%
1044733-65-4 / 3-(6-bromo-2-pyridinyl)-6-chloroimidazo[1,2-a]pyridine
3-(6-Bromopyridin-2-yl)-6-chloroimidazo[1,2-a]pyridine | MFCD14706831 | 3-(6-Bromopyridin-2-yl)-6-chloroimidazo-[1,2-a]pyridine
Basic Information
CAS
1044733-65-4
Multi CAS
No
Molecular Formula
C12H7BrClN3
Molecular Weight
308.560000
Exact Mass
306.951190
SMILES
C1=CC(=NC(=C1)Br)C2=CN=C3N2C=C(C=C3)Cl
InChI
InChI=1S/C12H7BrClN3/c13-11-3-1-2-9(16-11)10-6-15-12-5-4-8(14)7-17(10)12/h1-7H
InChIKey
HERAKKWSDPDIEN-UHFFFAOYSA-N
Synonyms
3-(6-Bromopyridin-2-yl)-6-chloroimidazo[1,2-a]pyridine
MFCD14706831
3-(6-Bromopyridin-2-yl)-6-chloroimidazo-[1,2-a]pyridine
DTXSID30743216
2-BROMO-6-{6-CHLOROIMIDAZO[1,2-A]PYRIDIN-3-YL}PYRIDINE
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
71.13
TPSA
30.19
LogP / Solubility
WLOGP
3.81
MLOGP
3.37
XLogP3
4
Consensus LogP
3.73
Log S (ESOL)
-4.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.95
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.9
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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