CAS RN: 1415981-79-1
Boc-NH-PEG12-CH2CH2COOH
Product Availability
Choose a grade to view its available package options.
9 package records9 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251111 | 100mg | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20260516 | 10g | In stock | Shanghai | Inquiry |
| Batchno.20250218 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20260606 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260629 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20251231 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-051970
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 | Beijing | Inquiry |
1415981-79-1 / 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Basic Information
CAS
1415981-79-1
Multi CAS
No
Molecular Formula
C32H63NO16
Molecular Weight
717.800000
Exact Mass
717.414685
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C32H63NO16/c1-32(2,3)49-31(36)33-5-7-38-9-11-40-13-15-42-17-19-44-21-23-46-25-27-48-29-28-47-26-24-45-22-20-43-18-16-41-14-12-39-10-8-37-6-4-30(34)35/h4-29H2,1-3H3,(H,33,36)(H,34,35)
InChIKey
QMJVJXMTYZIZKH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
49
Fraction Csp3
0.94
Rotatable bonds
39
H-bond acceptors
15
H-bond donors
2
Molar refractivity
176.32
TPSA
186.39
LogP / Solubility
WLOGP
1.19
MLOGP
1.1
XLogP3
-1.3
Consensus LogP
0.33
Log S (ESOL)
-2.46
Class (ESOL)
Moderately soluble
Log S (Ali)
-6.3
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.99
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.26
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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