CAS RN: 51219-88-6
TETRAMETHYLENE-D8 SULFONE
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.20251204 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS51219-88-6
- Purity/Analytical Methods: >99.0%
51219-88-6 / 2,2,3,3,4,4,5,5-octadeuteriothiolane 1,1-dioxide
Basic Information
CAS
51219-88-6
Multi CAS
Yes
Molecular Formula
C4H8O2S
Molecular Weight
128.220000
Exact Mass
128.074715
InChI
InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2/i1D2,2D2,3D2,4D2
InChIKey
HXJUTPCZVOIRIF-SVYQBANQSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
H-bond acceptors
2
Molar refractivity
27.89
TPSA
34.14
LogP / Solubility
WLOGP
0.2
MLOGP
0.16
XLogP3
-0.8
Consensus LogP
-0.15
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-0.69
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.6
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.31
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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