![CAS 892498-86-1 5-aminothiazolo[4,5-d]pyrimidine-2(3H)-thione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/892498-86-1.gif)
CAS RN: 892498-86-1
5-aminothiazolo[4,5-d]pyrimidine-2(3H)-thione
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.20250321 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS892498-86-1
- Purity/Analytical Methods: >99.0%
892498-86-1 / 5-amino-3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione
Basic Information
CAS
892498-86-1
Multi CAS
No
Molecular Formula
C5H4N4S2
Molecular Weight
184.200000
Exact Mass
183.987738
InChI
InChI=1S/C5H4N4S2/c6-4-7-1-2-3(8-4)9-5(10)11-2/h1H,(H3,6,7,8,9,10)
InChIKey
CPJXYEPRMYVJJH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
5
H-bond donors
2
Molar refractivity
47.01
TPSA
67.59
LogP / Solubility
WLOGP
1.33
MLOGP
1.17
XLogP3
0.5
Consensus LogP
1
Log S (ESOL)
-2.43
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.03
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.96
Class (SILICOS-IT)
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)
-2.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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