![CAS 2166118-43-8 (6R)-4-oxo-5-azaspiro[2.4]heptane-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2166118-43-8.png)
CAS RN: 2166118-43-8
(6R)-4-oxo-5-azaspiro[2.4]heptane-6-carboxylic acid
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.20250212 | 100mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: SSC-103900
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
2166118-43-8 / (6R)-4-oxo-5-azaspiro[2.4]heptane-6-carboxylic acid
Basic Information
CAS
2166118-43-8
Multi CAS
No
Molecular Formula
C7H9NO3
Molecular Weight
155.150000
Exact Mass
155.058243
SMILES
C1CC12C[C@@H](NC2=O)C(=O)O
InChI
InChI=1S/C7H9NO3/c9-5(10)4-3-7(1-2-7)6(11)8-4/h4H,1-3H2,(H,8,11)(H,9,10)/t4-/m1/s1
InChIKey
LFYFIPUSMXSACI-SCSAIBSYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.71
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
35.85
TPSA
66.4
LogP / Solubility
WLOGP
-0.26
MLOGP
-0.23
XLogP3
-0.4
Consensus LogP
-0.3
Log S (ESOL)
-0.57
Class (ESOL)
Very soluble
Log S (Ali)
-0.64
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.57
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)
-3.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 2166166-79-4 (1S,4R,5S)-2-[(tert-butoxy)carbonyl]-2-azabicyclo[2.2.1]heptane-5-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2166166-79-4.png)
