CAS RN: 1355318-41-0
O-(2,5,8,11-tetraoxatridecan-13-yl)hydroxylamine
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.20260129 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1355318-41-0
- Purity/Analytical Methods: >99.0%
1355318-41-0 / O-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]hydroxylamine
Basic Information
CAS
1355318-41-0
Multi CAS
No
Molecular Formula
C9H21NO5
Molecular Weight
223.270000
Exact Mass
223.141973
SMILES
COCCOCCOCCOCCON
InChI
InChI=1S/C9H21NO5/c1-11-2-3-12-4-5-13-6-7-14-8-9-15-10/h2-10H2,1H3
InChIKey
PGNJWXWIRDPTCM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
6
H-bond donors
1
Molar refractivity
54.47
TPSA
72.17
LogP / Solubility
WLOGP
-0.43
MLOGP
-0.37
XLogP3
-1.3
Consensus LogP
-0.7
Log S (ESOL)
-0.16
Class (ESOL)
Very soluble
Log S (Ali)
-1.08
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.2
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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