CAS RN: 13814-01-2
AMMONIUM-D8 SULFATE
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.20260127 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS13814-01-2
- Purity/Analytical Methods: >99.0%
13814-01-2 / bis(tetradeuterioazanium);sulfate
Basic Information
CAS
13814-01-2
Multi CAS
No
Molecular Formula
H8N2O4S
Molecular Weight
140.190000
Exact Mass
140.070692
SMILES
[2H][N+]([2H])([2H])[2H].[2H][N+]([2H])([2H])[2H].[O-]S(=O)(=O)[O-]
InChI
InChI=1S/2H3N.H2O4S/c;;1-5(2,3)4/h2*1H3;(H2,1,2,3,4)/i/hD8
InChIKey
BFNBIHQBYMNNAN-KTOHAENGSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
H-bond acceptors
4
H-bond donors
2
Molar refractivity
22.44
TPSA
153.26
LogP / Solubility
WLOGP
-0.59
MLOGP
-0.52
XLogP3
-0.59
Consensus LogP
-0.57
Log S (ESOL)
-0.29
Class (ESOL)
Very soluble
Log S (Ali)
-0.22
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.03
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)
-3.94
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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