CAS RN: 474945-24-9
18:1 EPC (Cl Salt)
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260223 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20251003 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20251202 | 10mg / 25mg / 50mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250421 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250410 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20251216 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS474945-24-9
- Purity/Analytical Methods: >99.0%
474945-24-9 / 2-[[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy]-ethoxyphosphoryl]oxyethyl-trimethylazanium chloride
Basic Information
CAS
474945-24-9
Multi CAS
Yes
Molecular Formula
C46H89CLNO8P
Molecular Weight
850.600000
Exact Mass
849.601434
InChI
InChI=1S/C46H89NO8P.ClH/c1-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-45(48)51-42-44(43-54-56(50,52-9-3)53-41-40-47(4,5)6)55-46(49)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-2;/h22-25,44H,7-21,26-43H2,1-6H3;1H/q+1;/p-1/b24-22-,25-23-;/t44-,56?;/m1./s1
InChIKey
LXTQBOAODSPEHG-NATHRRJOSA-M
Computed Properties
Structural Parameters
Heavy atom count
57
Fraction Csp3
0.87
Rotatable bonds
42
H-bond acceptors
8
Molar refractivity
233.78
TPSA
97.36
LogP / Solubility
WLOGP
10.4
MLOGP
9.23
XLogP3
10.4
Consensus LogP
10.01
Log S (ESOL)
-8.9
Class (ESOL)
Insoluble
Log S (Ali)
-14.05
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.86
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
Yes
Log Kp (skin permeation)
-0.52
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
5
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