CAS RN: 126150-97-8
Tetrakis(acetoxymethyl) 1,2-Bis(2-aminophenoxy)ethane-N,N,N’,N’-tetraacetate
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250927 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260108 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250806 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250711 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250911 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260520 | 25mg / 100mg / 250mg / 1g | Confirm by inquiry | Shanghai, Shandong, Guangdong | Inquiry |
| Batchno.20250617 | 50mg | In stock | Shanghai | Inquiry |
- Product code: SSC-032576
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 | Shenzhen | Inquiry |
126150-97-8 / acetyloxymethyl 2-[N-[2-(acetyloxymethoxy)-2-oxoethyl]-2-[2-[2-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]phenoxy]ethoxy]anilino]acetate
Basic Information
CAS
126150-97-8
Multi CAS
No
Molecular Formula
C34H40N2O18
Molecular Weight
764.700000
Exact Mass
764.227612
SMILES
CC(=O)OCOC(=O)CN(CC(=O)OCOC(=O)C)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C
InChI
InChI=1S/C34H40N2O18/c1-23(37)47-19-51-31(41)15-35(16-32(42)52-20-48-24(2)38)27-9-5-7-11-29(27)45-13-14-46-30-12-8-6-10-28(30)36(17-33(43)53-21-49-25(3)39)18-34(44)54-22-50-26(4)40/h5-12H,13-22H2,1-4H3
InChIKey
YJIYWYAMZFVECX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
54
Aromatic heavy atom count
12
Fraction Csp3
0.41
Rotatable bonds
23
H-bond acceptors
20
Molar refractivity
179.2
TPSA
235.34
LogP / Solubility
WLOGP
1.01
MLOGP
0.96
XLogP3
3.4
Consensus LogP
1.79
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-6.56
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.23
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)
-6.67
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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