CAS RN: 23470-00-0
2-MONOPALMITIN
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250227 | 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS23470-00-0
- Purity/Analytical Methods: >99.0%
23470-00-0 / 1,3-dihydroxypropan-2-yl hexadecanoate
Basic Information
CAS
23470-00-0
Multi CAS
No
Molecular Formula
C19H38O4
Molecular Weight
330.500000
Exact Mass
330.277010
SMILES
CCCCCCCCCCCCCCCC(=O)OC(CO)CO
InChI
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-18(16-20)17-21/h18,20-21H,2-17H2,1H3
InChIKey
BBNYCLAREVXOSG-UHFFFAOYSA-N
Physical Properties
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
23
Fraction Csp3
0.95
Rotatable bonds
17
H-bond acceptors
4
H-bond donors
2
Molar refractivity
94.36
TPSA
66.76
LogP / Solubility
WLOGP
4.36
MLOGP
3.86
XLogP3
6.1
Consensus LogP
4.77
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.42
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.47
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.64
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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