![CAS 52333-47-8 2-(4-Fluorophenyl)oxazolo[4,5-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52333-47-8.gif)
CAS RN: 52333-47-8
2-(4-Fluorophenyl)oxazolo[4,5-b]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.20260215 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS52333-47-8
- Purity/Analytical Methods: >99.0%
52333-47-8 / 2-(4-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridine
Basic Information
CAS
52333-47-8
Multi CAS
No
Molecular Formula
C12FH7N2O
Molecular Weight
214.190000
Exact Mass
214.054241
InChI
InChI=1S/C12H7FN2O/c13-9-5-3-8(4-6-9)12-15-11-10(16-12)2-1-7-14-11/h1-7H
InChIKey
RGYDWZUDJZVSSM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
57.2
TPSA
38.92
LogP / Solubility
WLOGP
3.03
MLOGP
2.67
XLogP3
2.8
Consensus LogP
2.83
Log S (ESOL)
-3.7
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.5
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.69
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.88
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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2-(2-Fluorophenyl)oxazolo[4,5-b]pyridine
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