![CAS 497058-00-1 3-CHLOROIMIDAZO[1,2-A]PYRIDINE-2-CARBALDEHYDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/497058-00-1.gif)
CAS RN: 497058-00-1
3-CHLOROIMIDAZO[1,2-A]PYRIDINE-2-CARBALDEHYDE
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.20250526 | 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS497058-00-1
- Purity/Analytical Methods: >99.0%
497058-00-1 / 3-chloroimidazo[1,2-a]pyridine-2-carbaldehyde
Basic Information
CAS
497058-00-1
Multi CAS
Yes
Molecular Formula
C8H5CLN2O
Molecular Weight
180.590000
Exact Mass
180.009041
InChI
InChI=1S/C8H5ClN2O/c9-8-6(5-12)10-7-3-1-2-4-11(7)8/h1-5H
InChIKey
QKIXDULAOFEVAE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
45.59
TPSA
34.37
LogP / Solubility
WLOGP
1.8
MLOGP
1.58
XLogP3
2.5
Consensus LogP
1.96
Log S (ESOL)
-2.58
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.34
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.54
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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