CAS RN: 54130-36-8
N-ETHYL-9ALPHA, 11ALPHA, 15S-TRIHYDROXY-PROSTA-5Z, 13E-DIEN-1-AMIDE
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.20250415 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS54130-36-8
- Purity/Analytical Methods: >99.0%
54130-36-8 / (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]-N-ethylhept-5-enamide
Basic Information
CAS
54130-36-8
Multi CAS
Yes
Molecular Formula
C22H39NO4
Molecular Weight
381.500000
Exact Mass
381.287909
InChI
InChI=1S/C22H39NO4/c1-3-5-8-11-17(24)14-15-19-18(20(25)16-21(19)26)12-9-6-7-10-13-22(27)23-4-2/h6,9,14-15,17-21,24-26H,3-5,7-8,10-13,16H2,1-2H3,(H,23,27)/b9-6-,15-14+/t17-,18+,19+,20-,21+/m0/s1
InChIKey
HLETUMXUCSCVPL-GWSKAPOCSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Fraction Csp3
0.77
Rotatable bonds
13
H-bond acceptors
4
H-bond donors
4
Molar refractivity
109.19
TPSA
89.79
LogP / Solubility
WLOGP
3.09
MLOGP
2.74
XLogP3
2.8
Consensus LogP
2.88
Log S (ESOL)
-3.3
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.92
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.27
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
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- CAS RN: 54135-60-3
- Product Code: starshine_CAS54135-60-3
- Purity/Analytical method: >99.0%
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