CAS RN: 4025-59-6
5BETA,6BETA-EPOXYCHOLESTAN-3BETA-OL
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.20250529 | 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS4025-59-6
- Purity/Analytical Methods: >99.0%
4025-59-6 / (1S,2R,5S,7S,9R,11S,12S,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-ol
Basic Information
CAS
4025-59-6
Multi CAS
Yes
Molecular Formula
C27H46O2
Molecular Weight
402.700000
Exact Mass
402.349781
InChI
InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,25-,26-,27-/m1/s1
InChIKey
PRYIJAGAEJZDBO-DTLXENBRSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
118.57
TPSA
32.76
LogP / Solubility
WLOGP
6.6
MLOGP
5.83
XLogP3
8
Consensus LogP
6.81
Log S (ESOL)
-6.16
Class (ESOL)
Insoluble
Log S (Ali)
-7.63
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.36
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)
-0.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
9.5
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- CAS RN: 4025-80-3
- Product Code: SSC-148329
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![CAS 4025-80-3 1-Methoxy-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/4025-80-3.gif)
