CAS RN: 3650-65-5
D-GLUCOSE ETHYLENEDITHIOACETAL 97
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.20251205 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS3650-65-5
- Purity/Analytical Methods: >99.0%
3650-65-5 / (1R,2S,3R,4R)-1-(1,3-dithiolan-2-yl)pentane-1,2,3,4,5-pentol
Basic Information
CAS
3650-65-5
Multi CAS
Yes
Molecular Formula
C8H16O5S2
Molecular Weight
256.300000
Exact Mass
256.043916
InChI
InChI=1S/C8H16O5S2/c9-3-4(10)5(11)6(12)7(13)8-14-1-2-15-8/h4-13H,1-3H2/t4-,5-,6+,7-/m1/s1
InChIKey
LOVIILREBFKRIA-MVIOUDGNSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
7
H-bond donors
5
Molar refractivity
59.82
TPSA
101.15
LogP / Solubility
WLOGP
-1.77
MLOGP
-1.55
XLogP3
-1.7
Consensus LogP
-1.67
Log S (ESOL)
0.02
Class (ESOL)
Highly soluble
Log S (Ali)
-0.38
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.46
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.54
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5
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