![CAS 778646-92-7 tert-butyl 8-oxo-5-azaspiro[3.5]nonane-5-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/778646-92-7.gif)
CAS RN: 778646-92-7
tert-butyl 8-oxo-5-azaspiro[3.5]nonane-5-carboxylate
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260402 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250925 | 100mg / 250mg / 500mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20260213 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250809 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250207 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-187404
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
778646-92-7 / tert-butyl 8-oxo-5-azaspiro[3.5]nonane-5-carboxylate
Basic Information
CAS
778646-92-7
Multi CAS
No
Molecular Formula
C13H21NO3
Molecular Weight
239.310000
Exact Mass
239.152144
InChI
InChI=1S/C13H21NO3/c1-12(2,3)17-11(16)14-8-5-10(15)9-13(14)6-4-7-13/h4-9H2,1-3H3
InChIKey
ASCBSGNUAQKGNU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.85
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
63.76
TPSA
46.61
LogP / Solubility
WLOGP
2.51
MLOGP
2.21
XLogP3
1.3
Consensus LogP
2.01
Log S (ESOL)
-2.9
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.33
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly 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)
-2.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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![CAS 778647-35-1 TERT-BUTYL 4-OXO-1-AZASPIRO[5.5]UNDECANE-1-CARBOXYLATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/778647-35-1.gif)
