CAS RN: 157182-49-5
R(+)-ARACHIDONYL-1′-HYDROXY-2′-PROPYLAMIDE
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250702 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS157182-49-5
- Purity/Analytical Methods: >99.0%
157182-49-5 / (5Z,8Z,11Z,14Z)-N-[(2R)-1-hydroxypropan-2-yl]icosa-5,8,11,14-tetraenamide
Basic Information
CAS
157182-49-5
Multi CAS
No
Molecular Formula
C23H39NO2
Molecular Weight
361.600000
Exact Mass
361.298079
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@H](C)CO
InChI
InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(26)24-22(2)21-25/h7-8,10-11,13-14,16-17,22,25H,3-6,9,12,15,18-21H2,1-2H3,(H,24,26)/b8-7-,11-10-,14-13-,17-16-/t22-/m1/s1
InChIKey
SQKRUBZPTNJQEM-FQPARAGTSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Fraction Csp3
0.61
Rotatable bonds
16
H-bond acceptors
2
H-bond donors
2
Molar refractivity
113.09
TPSA
49.33
LogP / Solubility
WLOGP
5.63
MLOGP
4.97
XLogP3
5.8
Consensus LogP
5.47
Log S (ESOL)
-4.57
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.59
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.6
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 157199-59-2 3-METHYL-2-([1-[3-(TRIMETHYLAMMONIO)PROPYL]-4(1H)-QUINOLINYLIDENE]METHYL)-1,3-BENZOTHIAZOL-3-IUM DIIODIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/157199-59-2.gif)
