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CAS 2353410-11-2 Azido-PEG8-hydrazide molecular structure lightbox
CAS RN: 2353410-11-2

Azido-PEG8-hydrazide

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250225 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS2353410-11-2
  • Purity/Analytical Methods: >99.0%
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2353410-11-2 / 3-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanehydrazide

Standard CAS: 2353410-11-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2353410-11-2
Multi CAS
No
Molecular Formula
C19H39N5O9
Molecular Weight
481.500000
Exact Mass
481.274778
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])C(=O)NN
InChI
InChI=1S/C19H39N5O9/c20-23-19(25)1-3-26-5-7-28-9-11-30-13-15-32-17-18-33-16-14-31-12-10-29-8-6-27-4-2-22-24-21/h1-18,20H2,(H,23,25)
InChIKey
XSHZSHNFUKYUOV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
33
Fraction Csp3
0.95
Rotatable bonds
27
H-bond acceptors
11
H-bond donors
2
Molar refractivity
117.51
TPSA
177.72

LogP / Solubility

WLOGP
-0.19
MLOGP
-0.13
XLogP3
-1.5
Consensus LogP
-0.61
Log S (ESOL)
-0.92
Class (ESOL)
Very soluble
Log S (Ali)
-3.37
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.87
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.79

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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