CAS RN: 2231664-15-4
(2S,3R)-3-fluoro-2-methylazetidine 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.20250826 | 100mg / 500mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-108781
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, 5g
- 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.
2231664-15-4 / (2S,3R)-3-fluoro-2-methylazetidine;hydrochloride
Basic Information
CAS
2231664-15-4
Multi CAS
No
Molecular Formula
C4H9ClFN
Molecular Weight
125.570000
Exact Mass
125.040755
SMILES
C[C@H]1[C@@H](CN1)F.Cl
InChI
InChI=1S/C4H8FN.ClH/c1-3-4(5)2-6-3;/h3-4,6H,2H2,1H3;1H/t3-,4+;/m0./s1
InChIKey
LCIMHSJEJTYTNF-RFKZQXLXSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
29.61
TPSA
12.03
LogP / Solubility
WLOGP
0.74
MLOGP
0.64
XLogP3
0.74
Consensus LogP
0.71
Log S (ESOL)
-1.08
Class (ESOL)
Soluble
Log S (Ali)
-1.12
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.09
Class (SILICOS-IT)
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)
-2.96
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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