![CAS 2740593-38-6 [(2S)-oxetan-2-yl]methana mine-4-methylbenzenesul fonic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2740593-38-6.gif)
CAS RN: 2740593-38-6
[(2S)-oxetan-2-yl]methana mine-4-methylbenzenesul fonic acid
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250109 | 250mg / 1g / 5g / 25g / 100g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: SSC-126660
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 5g, 10g, 1g, 25g, 100g
- Available purity: >98%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | >98% | 4 In Stock | Hong Kong | Inquiry |
| 10g | >98% | 4 In Stock | Beijing | Inquiry |
| 1g | >98% | 3 In Stock | Beijing | Inquiry |
| 25g | >98% | 3 In Stock | Shenzhen | Inquiry |
| 100g | >98% | 2 In Stock | Hong Kong | Inquiry |
2740593-38-6 / 4-methylbenzenesulfonic acid;[(2S)-oxetan-2-yl]methanamine
Basic Information
CAS
2740593-38-6
Multi CAS
Yes
Molecular Formula
C11H17NO4S
Molecular Weight
259.320000
Exact Mass
259.087829
InChI
InChI=1S/C7H8O3S.C4H9NO/c1-6-2-4-7(5-3-6)11(8,9)10;5-3-4-1-2-6-4/h2-5H,1H3,(H,8,9,10);4H,1-3,5H2/t;4-/m.0/s1
InChIKey
YLMXEOCOICWSKH-VWMHFEHESA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
64.41
TPSA
89.62
LogP / Solubility
WLOGP
0.98
MLOGP
0.87
XLogP3
0.98
Consensus LogP
0.94
Log S (ESOL)
-2.19
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.4
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
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)
-3.61
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
2
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