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CAS 126824-24-6 Tetrasodium 1,2-Bis(2-aminophenoxy)ethane-N,N,N’,N’-tetraacetate molecular structure lightbox
CAS RN: 126824-24-6

Tetrasodium 1,2-Bis(2-aminophenoxy)ethane-N,N,N’,N’-tetraacetate

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260227 1g In stock Inquiry
Batchno.20250928 250mg In stock Inquiry
Batchno.20251216 5g In stock Inquiry
  • Product code: SSC-034041
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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
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 126824-24-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

126824-24-6 / tetrasodium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]phenoxy]ethoxy]-N-(carboxylatomethyl)anilino]acetate

Standard CAS: 126824-24-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
126824-24-6
Multi CAS
No
Molecular Formula
C22H20N2Na4O10
Molecular Weight
564.400000
Exact Mass
564.070872
SMILES
C1=CC=C(C(=C1)N(CC(=O)[O-])CC(=O)[O-])OCCOC2=CC=CC=C2N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]
InChI
InChI=1S/C22H24N2O10.4Na/c25-19(26)11-23(12-20(27)28)15-5-1-3-7-17(15)33-9-10-34-18-8-4-2-6-16(18)24(13-21(29)30)14-22(31)32;;;;/h1-8H,9-14H2,(H,25,26)(H,27,28)(H,29,30)(H,31,32);;;;/q;4*+1/p-4
InChIKey
ZWSMLJACYSGFKD-UHFFFAOYSA-J

Computed Properties

Structural Parameters

Heavy atom count
38
Aromatic heavy atom count
12
Fraction Csp3
0.27
Rotatable bonds
15
H-bond acceptors
12
Molar refractivity
108.33
TPSA
185.46

LogP / Solubility

WLOGP
-16.23
MLOGP
-14.24
XLogP3
-16.23
Consensus LogP
-15.57
Log S (ESOL)
7.64
Class (ESOL)
Highly soluble
Log S (Ali)
7.53
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
8.34
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-17.68

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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