CAS RN: 80082-65-1
(2S-trans)-3-Amino-2-methyl-4-oxoazetidine-1-sulphonic acid
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250110 | 100g | In stock | Shanghai | Inquiry | |
| Batchno.20250910 | 10g | In stock | Shanghai | Inquiry | |
| Batchno.20251202 | 1g | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20260514 | 25g | In stock | Shanghai | Inquiry | |
| Batchno.20260227 | 500g | Out of stock | Inquiry | ||
| Batchno.20260327 | 5g | In stock | Shanghai | Inquiry | |
| Batchno.20250520 | 5g / 10g / 25g / 100g / 500g | Confirm by inquiry | Shandong, Shanghai, Guangdong, Chongqing | 5-7 business days | Inquiry |
- Product code: SSC-189084
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: 25g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 25g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
80082-65-1 / (2S,3S)-3-amino-2-methyl-4-oxoazetidine-1-sulfonic acid
Basic Information
CAS
80082-65-1
Multi CAS
Yes
Molecular Formula
C4H8N2O4S
Molecular Weight
180.190000
Exact Mass
180.020478
InChI
InChI=1S/C4H8N2O4S/c1-2-3(5)4(7)6(2)11(8,9)10/h2-3H,5H2,1H3,(H,8,9,10)/t2-,3-/m0/s1
InChIKey
ISUIVWNWEDIHJD-HRFVKAFMSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
35.83
TPSA
100.7
LogP / Solubility
WLOGP
-1.65
MLOGP
-1.46
XLogP3
-3.6
Consensus LogP
-2.24
Log S (ESOL)
0.15
Class (ESOL)
Highly soluble
Log S (Ali)
0.16
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.42
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.99
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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