![CAS 1263059-26-2 Methyl 5-Chloropyrazolo[1,5-A]Pyrimidine-2-Carboxylate(WX130133) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1263059-26-2.gif)
CAS RN: 1263059-26-2
Methyl 5-Chloropyrazolo[1,5-A]Pyrimidine-2-Carboxylate(WX130133)
Product Availability
Choose a grade to view its available package options.
4 package records0 with current stock1 grade group
- Product code: SSC-033304
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1263059-26-2 / methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate
Basic Information
CAS
1263059-26-2
Multi CAS
No
Molecular Formula
C8H6ClN3O2
Molecular Weight
211.600000
Exact Mass
211.014854
SMILES
COC(=O)C1=NN2C=CC(=NC2=C1)Cl
InChI
InChI=1S/C8H6ClN3O2/c1-14-8(13)5-4-7-10-6(9)2-3-12(7)11-5/h2-4H,1H3
InChIKey
GZELJABQLTVHPY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
5
Molar refractivity
49.34
TPSA
56.49
LogP / Solubility
WLOGP
1.17
MLOGP
1.03
XLogP3
1.5
Consensus LogP
1.23
Log S (ESOL)
-2.3
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.13
Class (SILICOS-IT)
Moderately 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)
-3.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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Ethyl 3-broMopyrazolo[1,5-a]pyriMidine-6-carboxylate
- CAS RN: 1263060-07-6
- Product Code: SSC-033309
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![CAS 1263060-07-6 Ethyl 3-broMopyrazolo[1,5-a]pyriMidine-6-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1263060-07-6.gif)
