CAS RN: 474943-13-0
dioctanoylglycerol pyrophosphate (aMMoniuM salt)
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.20250520 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS474943-13-0
- Purity/Analytical Methods: >99.0%
474943-13-0 / diazanium;[[(2R)-2,3-di(octanoyloxy)propoxy]-oxidophosphoryl] hydrogen phosphate
Basic Information
CAS
474943-13-0
Multi CAS
Yes
Molecular Formula
C19H44N2O11P2
Molecular Weight
538.500000
Exact Mass
538.242034
InChI
InChI=1S/C19H38O11P2.2H3N/c1-3-5-7-9-11-13-18(20)27-15-17(16-28-32(25,26)30-31(22,23)24)29-19(21)14-12-10-8-6-4-2;;/h17H,3-16H2,1-2H3,(H,25,26)(H2,22,23,24);2*1H3/t17-;;/m1../s1
InChIKey
XNPNJXYONHGAON-ZEECNFPPSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Fraction Csp3
0.89
Rotatable bonds
20
H-bond acceptors
10
H-bond donors
3
Molar refractivity
124.03
TPSA
244.55
LogP / Solubility
WLOGP
3.88
MLOGP
3.45
XLogP3
3.88
Consensus LogP
3.74
Log S (ESOL)
-4.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.78
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.78
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.25
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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![CAS 474944-16-6 1,2-dipalMitoyl-sn-glycero-3-phosphoethanolaMine-N-[3-(2-pyridyldithio)propionate] (sodiuM salt) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/474944-16-6.gif)
![CAS 474944-36-0 7-[(3R)-3-[[(1,1-diMethylethyl)diMethylsilyl]oxy]-5-oxo-1-cyclopenten-1-yl]-(5Z)-Heptenoic acid-1-Methylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/474944-36-0.gif)
