![CAS 478064-03-8 Pyrazolo[1,5-a]pyrimidine, 6-chloro-2,5,7-trimethyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/478064-03-8.gif)
CAS RN: 478064-03-8
Pyrazolo[1,5-a]pyrimidine, 6-chloro-2,5,7-trimethyl-
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.20251011 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
- Product code: starshine_CAS478064-03-8
- Purity/Analytical Methods: >99.0%
478064-03-8 / 6-chloro-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine
Basic Information
CAS
478064-03-8
Multi CAS
No
Molecular Formula
C9H10CLN3
Molecular Weight
195.650000
Exact Mass
195.056325
InChI
InChI=1S/C9H10ClN3/c1-5-4-8-11-6(2)9(10)7(3)13(8)12-5/h4H,1-3H3
InChIKey
PFQLHGAFXJLZPY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.33
H-bond acceptors
3
Molar refractivity
52.21
TPSA
30.19
LogP / Solubility
WLOGP
2.31
MLOGP
2.03
XLogP3
2.2
Consensus LogP
2.18
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.83
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.85
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.27
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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