CAS RN: 933724-39-1
[1,2,4]Triazolo[1,5-a]pyrimidine-6-carbaldehyde
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250203 |
100mg / 250mg / 500mg |
Out of stock |
1 business days | Inquiry |
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Product code:
starshine_CAS933724-39-1
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Purity/Analytical Methods:
>99.0%
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933724-39-1 / [1,2,4]triazolo[1,5-a]pyrimidine-6-carbaldehyde
Standard CAS: 933724-39-1
Multi CAS: No
Basic Information
CAS
933724-39-1
Multi CAS
No
Molecular Formula
C6H4N4O
Molecular Weight
148.120000
Exact Mass
148.038511
InChI
InChI=1S/C6H4N4O/c11-3-5-1-7-6-8-4-9-10(6)2-5/h1-4H
InChIKey
HUXMAEVVLRUGJA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
5
Molar refractivity
36.17
TPSA
60.15
LogP / Solubility
WLOGP
-0.06
MLOGP
-0.06
XLogP3
-0.4
Consensus LogP
-0.17
Log S (ESOL)
-1.26
Class (ESOL)
Soluble
Log S (Ali)
-0.73
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.69
Class (SILICOS-IT)
Very 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)
-3.67
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