CAS RN: 4725-51-3
Androstane-3,5,6-triol,(3,5,6)-(9CI)
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.20250804 | 5mg / 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS4725-51-3
- Purity/Analytical Methods: >99.0%
4725-51-3 / 10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
Basic Information
CAS
4725-51-3
Multi CAS
Yes
Molecular Formula
C19H32O3
Molecular Weight
308.500000
Exact Mass
308.235145
InChI
InChI=1S/C19H32O3/c1-17-7-3-4-14(17)13-10-16(21)19(22)11-12(20)5-9-18(19,2)15(13)6-8-17/h12-16,20-22H,3-11H2,1-2H3/t12-,13-,14-,15-,16+,17-,18+,19-/m0/s1
InChIKey
IFRIPYPBJCUNAG-OTMXHXQLSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
85.2
TPSA
60.69
LogP / Solubility
WLOGP
2.87
MLOGP
2.53
XLogP3
3.5
Consensus LogP
2.97
Log S (ESOL)
-3.56
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.04
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
7
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