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CAS 206265-96-5 BocNH-PEG7-CH2CH2N3 molecular structure lightbox
CAS RN: 206265-96-5

BocNH-PEG7-CH2CH2N3

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260110 100mg Out of stock 15 business days Inquiry
  • Product code: SSC-097229
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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: >95%
  • 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 206265-96-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 2 In Stock Hong Kong Inquiry
0.1g >95% 2 In Stock Beijing Inquiry
0.25g -- 2 In Stock Hong Kong Inquiry
0.25g >95% 2 In Stock Shanghai Inquiry
1g -- 2 In Stock Shanghai Inquiry
1g >95% 2 In Stock Beijing Inquiry

206265-96-5 / tert-butyl N-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate

Standard CAS: 206265-96-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
206265-96-5
Multi CAS
No
Molecular Formula
C21H42N4O9
Molecular Weight
494.600000
Exact Mass
494.295179
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCN=[N+]=[N-]
InChI
InChI=1S/C21H42N4O9/c1-21(2,3)34-20(26)23-4-6-27-8-10-29-12-14-31-16-18-33-19-17-32-15-13-30-11-9-28-7-5-24-25-22/h4-19H2,1-3H3,(H,23,26)
InChIKey
ZNEWYWROTJUFAM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Fraction Csp3
0.95
Rotatable bonds
24
H-bond acceptors
10
H-bond donors
1
Molar refractivity
123.98
TPSA
151.7

LogP / Solubility

WLOGP
1.94
MLOGP
1.74
XLogP3
0.8
Consensus LogP
1.49
Log S (ESOL)
-2.54
Class (ESOL)
Moderately soluble
Log S (Ali)
-5.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.36
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)
-4.36

Drug-likeness / Medicinal Chemistry

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

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