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CAS 2054339-01-2 N-Boc-N-bis(PEG2-acid) molecular structure lightbox
CAS RN: 2054339-01-2

N-Boc-N-bis(PEG2-acid)

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251123 1g Out of stock 15 business days Inquiry
  • Product code: SSC-096597
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2054339-01-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 5 In Stock Hong Kong Inquiry
0.1g >97% 5 In Stock Hong Kong Inquiry
0.25g -- 5 In Stock Shenzhen Inquiry
0.25g >97% 5 In Stock Shenzhen Inquiry
1g -- 5 In Stock Beijing Inquiry
1g >97% 5 In Stock Hong Kong Inquiry

2054339-01-2 / 3-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]ethoxy]propanoic acid

Standard CAS: 2054339-01-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2054339-01-2
Multi CAS
No
Molecular Formula
C19H35NO10
Molecular Weight
437.500000
Exact Mass
437.226096
SMILES
CC(C)(C)OC(=O)N(CCOCCOCCC(=O)O)CCOCCOCCC(=O)O
InChI
InChI=1S/C19H35NO10/c1-19(2,3)30-18(25)20(6-10-28-14-12-26-8-4-16(21)22)7-11-29-15-13-27-9-5-17(23)24/h4-15H2,1-3H3,(H,21,22)(H,23,24)
InChIKey
BCKFXKJMBCVDJV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Fraction Csp3
0.84
Rotatable bonds
18
H-bond acceptors
8
H-bond donors
2
Molar refractivity
105.59
TPSA
141.06

LogP / Solubility

WLOGP
1.24
MLOGP
1.12
XLogP3
-0.5
Consensus LogP
0.62
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.04
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly soluble

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)
-4.51

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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