CAS RN: 20636-41-3
2,4,5-TRIHYDROXYPYRIMIDINE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251213 | 100mg / 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: starshine_CAS20636-41-3
- Purity/Analytical Methods: >99.0%
20636-41-3 / 5-hydroxy-1H-pyrimidine-2,4-dione
Basic Information
CAS
20636-41-3
Multi CAS
No
Molecular Formula
C4H4N2O3
Molecular Weight
128.090000
Exact Mass
128.022192
SMILES
C1=C(C(=O)NC(=O)N1)O
InChI
InChI=1S/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1,7H,(H2,5,6,8,9)
InChIKey
OFJNVANOCZHTMW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
3
H-bond donors
3
Molar refractivity
29.35
TPSA
85.95
LogP / Solubility
WLOGP
-1.23
MLOGP
-1.09
XLogP3
-1.1
Consensus LogP
-1.14
Log S (ESOL)
-0.35
Class (ESOL)
Very soluble
Log S (Ali)
0.28
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.53
Class (SILICOS-IT)
Highly 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)
-4.38
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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