CAS RN: 5309-46-6

L-ALPHA-PALMITIN

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260522 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS5309-46-6
  • Purity/Analytical Methods: >99.0%
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5309-46-6 / 2,3-dihydroxypropyl hexadecanoate

Standard CAS: 5309-46-6 Multi CAS: Yes

Basic Information

CAS
5309-46-6
Multi CAS
Yes
Molecular Formula
C19H38O4
Molecular Weight
330.500000
Exact Mass
330.277010
InChI
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3/t18-/m1/s1
InChIKey
QHZLMUACJMDIAE-GOSISDBHSA-N

Physical Properties

Physical Description
White powder
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
6.3
Consensus LogP
4.84
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
3

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