![CAS 910332-68-2 7-Azabicyclo[2.2.1]heptane-2,7-dicarboxylic acid, 3-oxo-, 7-(1,1-dimethylethyl) 2-methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/910332-68-2.gif)
CAS RN: 910332-68-2
7-Azabicyclo[2.2.1]heptane-2,7-dicarboxylic acid, 3-oxo-, 7-(1,1-dimethylethyl) 2-methyl ester
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.20251026 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-203831
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 | Beijing | Inquiry |
910332-68-2 / 7-O-tert-butyl 2-O-methyl 3-oxo-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate
Basic Information
CAS
910332-68-2
Multi CAS
Yes
Molecular Formula
C13H19NO5
Molecular Weight
269.290000
Exact Mass
269.126323
InChI
InChI=1S/C13H19NO5/c1-13(2,3)19-12(17)14-7-5-6-8(14)10(15)9(7)11(16)18-4/h7-9H,5-6H2,1-4H3
InChIKey
FRSSKCYREXGZOH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Fraction Csp3
0.77
Rotatable bonds
1
H-bond acceptors
5
Molar refractivity
65.4
TPSA
72.91
LogP / Solubility
WLOGP
1.13
MLOGP
1
XLogP3
1.4
Consensus LogP
1.18
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.47
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.56
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
5
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![CAS 910442-23-8 5-(4-TRIFLUOROMETHOXY-PHENYL)-[1,3,4]OXADIAZOL-2-YLAMINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/910442-23-8.gif)