CAS RN: 39944-62-2
2,4,5,6-Tetraaminopyrimidine dihydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251014 | 10g / 50g / 250g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS39944-62-2
- Purity/Analytical Methods: >99.0%
39944-62-2 / pyrimidine-2,4,5,6-tetramine;hydrochloride
Basic Information
CAS
39944-62-2
Multi CAS
Yes
Molecular Formula
C4H9CLN6
Molecular Weight
176.610000
Exact Mass
176.057722
InChI
InChI=1S/C4H8N6.2ClH/c5-1-2(6)9-4(8)10-3(1)7;;/h5H2,(H6,6,7,8,9,10);2*1H
InChIKey
BKYYVSKCYPCEAU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
H-bond acceptors
6
H-bond donors
4
Molar refractivity
46.93
TPSA
129.86
LogP / Solubility
WLOGP
-0.77
MLOGP
-0.68
XLogP3
-0.77
Consensus LogP
-0.74
Log S (ESOL)
-0.85
Class (ESOL)
Very soluble
Log S (Ali)
-0.45
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.17
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)
-4.35
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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