![CAS 738551-49-0 6-Hydroxy-2-azabicyclo[2.2.2]octane hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/738551-49-0.gif)
CAS RN: 738551-49-0
6-Hydroxy-2-azabicyclo[2.2.2]octane hydrochloride
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.20260122 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS738551-49-0
- Purity/Analytical Methods: >99.0%
738551-49-0 / 2-azabicyclo[2.2.2]octan-6-ol
Basic Information
CAS
738551-49-0
Multi CAS
Yes
Molecular Formula
C7H13NO
Molecular Weight
127.180000
Exact Mass
127.099714
InChI
InChI=1S/C7H13NO/c9-7-3-5-1-2-6(7)8-4-5/h5-9H,1-4H2
InChIKey
WTHAVLKCRJPDGR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
35.14
TPSA
32.26
LogP / Solubility
WLOGP
0.12
MLOGP
0.1
XLogP3
0.1
Consensus LogP
0.11
Log S (ESOL)
-0.7
Class (ESOL)
Very soluble
Log S (Ali)
-0.69
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.59
Class (SILICOS-IT)
Very 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)
-3.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
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