CAS RN: 1372860-04-2
m-PEG8-succinimidyl carbonate
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.20260503 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1372860-04-2
- Purity/Analytical Methods: >99.0%
1372860-04-2 / (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl carbonate
Basic Information
CAS
1372860-04-2
Multi CAS
No
Molecular Formula
C22H39NO13
Molecular Weight
525.500000
Exact Mass
525.242140
SMILES
COCCOCCOCCOCCOCCOCCOCCOCCOC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C22H39NO13/c1-27-4-5-28-6-7-29-8-9-30-10-11-31-12-13-32-14-15-33-16-17-34-18-19-35-22(26)36-23-20(24)2-3-21(23)25/h2-19H2,1H3
InChIKey
KGBOFEYHJAHPNI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Fraction Csp3
0.86
Rotatable bonds
25
H-bond acceptors
13
Molar refractivity
121.13
TPSA
146.75
LogP / Solubility
WLOGP
-0.03
MLOGP
0.01
XLogP3
-1.5
Consensus LogP
-0.51
Log S (ESOL)
-1.43
Class (ESOL)
Soluble
Log S (Ali)
-3.85
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-6.05
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.95
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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