CAS RN: 6983-79-5
Bixin
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.20260401 | 1mg / 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS6983-79-5
- Purity/Analytical Methods: >99.0%
6983-79-5 / 20-methoxy-4,8,13,17-tetramethyl-20-oxoicosa-2,4,6,8,10,12,14,16,18-nonaenoic acid
Basic Information
CAS
6983-79-5
Multi CAS
Yes
Molecular Formula
C25H30O4
Molecular Weight
394.500000
Exact Mass
394.214409
InChI
InChI=1S/C25H30O4/c1-20(12-8-14-22(3)16-18-24(26)27)10-6-7-11-21(2)13-9-15-23(4)17-19-25(28)29-5/h6-19H,1-5H3,(H,26,27)/b7-6+,12-8+,13-9+,18-16+,19-17+,20-10+,21-11+,22-14+,23-15-
InChIKey
RAFGELQLHMBRHD-SLEZCNMESA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Fraction Csp3
0.2
Rotatable bonds
10
H-bond acceptors
3
H-bond donors
1
Molar refractivity
120.38
TPSA
63.6
LogP / Solubility
WLOGP
5.81
MLOGP
5.14
XLogP3
7.5
Consensus LogP
6.15
Log S (ESOL)
-5.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.99
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.25
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
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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