CAS RN: 25359-71-1
Dipentaerythritol Hexakis(3-mercaptopropionate)
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260601 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20260317 | 100g | In stock | Shanghai, Guangdong, Chongqing | Inquiry |
| Batchno.20260521 | 1kg | Out of stock | Inquiry | |
| Batchno.20251211 | 25g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry |
| Batchno.20260122 | 25g | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250206 | 500g | In stock | Shanghai | Inquiry |
| Batchno.20260313 | 500g | In stock | Shanghai | Inquiry |
- Product code: SSC-121257
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: 100g
- Available purity: ≥93%
- 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 |
|---|---|---|---|---|
| 100g | ≥93% | 0 Out of Stock | Shenzhen | Inquiry |
25359-71-1 / [3-(3-sulfanylpropanoyloxy)-2-[[3-(3-sulfanylpropanoyloxy)-2,2-bis(3-sulfanylpropanoyloxymethyl)propoxy]methyl]-2-(3-sulfanylpropanoyloxymethyl)propyl] 3-sulfanylpropanoate
Basic Information
CAS
25359-71-1
Multi CAS
No
Molecular Formula
C28H46O13S6
Molecular Weight
783.100000
Exact Mass
782.126269
SMILES
C(CS)C(=O)OCC(COCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS
InChI
InChI=1S/C28H46O13S6/c29-21(1-7-42)36-15-27(16-37-22(30)2-8-43,17-38-23(31)3-9-44)13-35-14-28(18-39-24(32)4-10-45,19-40-25(33)5-11-46)20-41-26(34)6-12-47/h42-47H,1-20H2
InChIKey
YAAUVJUJVBJRSQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
47
Fraction Csp3
0.79
Rotatable bonds
28
H-bond acceptors
19
H-bond donors
6
Molar refractivity
192.26
TPSA
167.03
LogP / Solubility
WLOGP
2.15
MLOGP
1.97
XLogP3
1
Consensus LogP
1.71
Log S (ESOL)
-4.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.54
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.9
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.97
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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