CAS RN: 1083325-87-4
7-bromo-2-(1-methyl-1H-pyrazol-4-yl)Quinoxaline
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.20250804 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-009722
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: ＞97%
- 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 | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
1083325-87-4 / 7-bromo-2-(1-methylpyrazol-4-yl)quinoxaline
7-bromo-2-(1-methyl-1H-pyrazol-4-yl)quinoxaline | 7-bromo-2-(1-methylpyrazol-4-yl)quinoxaline | MFCD28128013
Basic Information
CAS
1083325-87-4
Multi CAS
No
Molecular Formula
C12H9BrN4
Molecular Weight
289.130000
Exact Mass
288.001060
SMILES
CN1C=C(C=N1)C2=CN=C3C=CC(=CC3=N2)Br
InChI
InChI=1S/C12H9BrN4/c1-17-7-8(5-15-17)12-6-14-10-3-2-9(13)4-11(10)16-12/h2-7H,1H3
InChIKey
YNUKVBWZLAROPU-UHFFFAOYSA-N
Synonyms
7-bromo-2-(1-methyl-1H-pyrazol-4-yl)quinoxaline
7-bromo-2-(1-methylpyrazol-4-yl)quinoxaline
MFCD28128013
7-Bromo-2-(1-methyl-1H-pyrazol-4-yl)-quinoxaline
SCHEMBL2591038
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
15
Fraction Csp3
0.08
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
69.44
TPSA
43.6
LogP / Solubility
WLOGP
2.79
MLOGP
2.47
XLogP3
1.9
Consensus LogP
2.39
Log S (ESOL)
-3.98
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.95
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.5
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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