![CAS 34532-68-8 (3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(methacryloyloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34532-68-8.gif)
CAS RN: 34532-68-8
(3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(methacryloyloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251230 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS34532-68-8
- Purity/Analytical Methods: >99.0%
34532-68-8 / [(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] 2-methylprop-2-enoate
Basic Information
CAS
34532-68-8
Multi CAS
Yes
Molecular Formula
C19H24O5
Molecular Weight
332.400000
Exact Mass
332.162374
InChI
InChI=1S/C19H24O5/c1-9(2)17(21)24-16-15-11(4)18(22)23-13(15)8-10(3)12-6-7-14(20)19(12,16)5/h6-7,10-13,15-16H,1,8H2,2-5H3/t10-,11+,12+,13-,15-,16+,19+/m1/s1
InChIKey
NZESEVTYUVXOTC-APDQSUQKSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Fraction Csp3
0.63
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
86.75
TPSA
69.67
LogP / Solubility
WLOGP
2.45
MLOGP
2.17
XLogP3
2.1
Consensus LogP
2.24
Log S (ESOL)
-3.31
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.06
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.1
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)
-3.01
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
6
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- Product Code: starshine_CAS34539-65-6
- Purity/Analytical method: >99.0%
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