CAS RN: 581065-93-2
(2-pyridyldithio)-PEG4 acid
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260210 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250111 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260528 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260105 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20251201 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-166329
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 | Shanghai | Inquiry |
581065-93-2 / 3-[2-[2-[2-[2-(pyridin-2-yldisulfanyl)ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Basic Information
CAS
581065-93-2
Multi CAS
No
Molecular Formula
C16H25NO6S2
Molecular Weight
391.500000
Exact Mass
391.112330
InChI
InChI=1S/C16H25NO6S2/c18-16(19)4-6-20-7-8-21-9-10-22-11-12-23-13-14-24-25-15-3-1-2-5-17-15/h1-3,5H,4,6-14H2,(H,18,19)
InChIKey
YOJQJVOLXIGESQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
17
H-bond acceptors
8
H-bond donors
1
Molar refractivity
98.08
TPSA
87.11
LogP / Solubility
WLOGP
2.36
MLOGP
2.1
XLogP3
0.6
Consensus LogP
1.69
Log S (ESOL)
-2.81
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.48
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.21
Class (SILICOS-IT)
Insoluble
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)
-3.43
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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