CAS RN: 2182601-79-0
Bis(m-PEG4)-N-OH
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260520 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS2182601-79-0
- Purity/Analytical Methods: >99.0%
2182601-79-0 / N,N-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]hydroxylamine
Basic Information
CAS
2182601-79-0
Multi CAS
No
Molecular Formula
C18H39NO9
Molecular Weight
413.500000
Exact Mass
413.262482
SMILES
COCCOCCOCCOCCN(CCOCCOCCOCCOC)O
InChI
InChI=1S/C18H39NO9/c1-21-7-9-25-15-17-27-13-11-23-5-3-19(20)4-6-24-12-14-28-18-16-26-10-8-22-2/h20H,3-18H2,1-2H3
InChIKey
SHFFXGVDVNYUOA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Fraction Csp3
1
Rotatable bonds
24
H-bond acceptors
10
H-bond donors
1
Molar refractivity
102.03
TPSA
97.31
LogP / Solubility
WLOGP
0.07
MLOGP
0.09
XLogP3
-1.4
Consensus LogP
-0.41
Log S (ESOL)
-0.86
Class (ESOL)
Very soluble
Log S (Ali)
-3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.29
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
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)
-5.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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