CAS RN: 2144777-73-9
(2-pyridyldithio)-PEG2-t-butyl ester
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.20250227 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: SSC-102839
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ＞95% | 0 Out of Stock | Beijing | Inquiry |
2144777-73-9 / tert-butyl 3-[2-[2-(pyridin-2-yldisulfanyl)ethoxy]ethoxy]propanoate
Basic Information
CAS
2144777-73-9
Multi CAS
No
Molecular Formula
C16H25NO4S2
Molecular Weight
359.500000
Exact Mass
359.122501
SMILES
CC(C)(C)OC(=O)CCOCCOCCSSC1=CC=CC=N1
InChI
InChI=1S/C16H25NO4S2/c1-16(2,3)21-15(18)7-9-19-10-11-20-12-13-22-23-14-6-4-5-8-17-14/h4-6,8H,7,9-13H2,1-3H3
InChIKey
NFTUEHOZCVWJPT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
11
H-bond acceptors
7
Molar refractivity
94.65
TPSA
57.65
LogP / Solubility
WLOGP
3.59
MLOGP
3.18
XLogP3
2.2
Consensus LogP
2.99
Log S (ESOL)
-3.8
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.1
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.29
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
Azido-PEG5-CH2CO2-PFP
- CAS RN: 2144777-92-2
- Product Code: starshine_CAS2144777-92-2
- Purity/Analytical method: >99.0%
-
Cyclopenta[d]-1,2,3-oxathiazole-3(3aH)-carboxylic acid, tetrahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aS,6aR)-
- CAS RN: 2145122-45-6
- Product Code: SSC-102861
-
11-epi-morgroside V
- CAS RN: 2146088-12-0
- Product Code: starshine_CAS2146088-12-0
- Purity/Analytical method: >99.0%
-
Mogroside VI A
- CAS RN: 2146088-13-1
- Product Code: starshine_CAS2146088-13-1
- Purity/Analytical method: >99.0%
-
N,N’,N”-tris(3-pyridinyl) phosphorothioic triamide
- CAS RN: 2146095-56-7
- Product Code: SSC-102897
![CAS 2145122-45-6 Cyclopenta[d]-1,2,3-oxathiazole-3(3aH)-carboxylic acid, tetrahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aS,6aR)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2145122-45-6.png)
