![CAS 1630906-50-1 sodiuM 6-chloro-[1,2,4]triazolo[4,3-b]pyridazine-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB22704797.gif)
CAS RN: 1630906-50-1
sodiuM 6-chloro-[1,2,4]triazolo[4,3-b]pyridazine-3-carboxylate
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250623 | 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-070742
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 | Shanghai | Inquiry |
1630906-50-1 / sodium 6-chloro-[1,2,4]triazolo[4,3-b]pyridazine-3-carboxylate
Basic Information
CAS
1630906-50-1
Multi CAS
No
Molecular Formula
C6H2ClN4NaO2
Molecular Weight
220.550000
Exact Mass
219.976397
SMILES
C1=CC(=NN2C1=NN=C2C(=O)[O-])Cl.[Na+]
InChI
InChI=1S/C6H3ClN4O2.Na/c7-3-1-2-4-8-9-5(6(12)13)11(4)10-3;/h1-2H,(H,12,13);/q;+1/p-1
InChIKey
WNMOGTVHNVQMSJ-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
6
Molar refractivity
40.12
TPSA
83.21
LogP / Solubility
WLOGP
-3.85
MLOGP
-3.39
XLogP3
-3.85
Consensus LogP
-3.7
Log S (ESOL)
0.81
Class (ESOL)
Highly soluble
Log S (Ali)
1.41
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.99
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)
-6.8
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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