CAS RN: 282528-30-7
2,3-Bis(broMoMethyl)pyrazine
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g
- Available purity: >95%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 282528-30-7
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
1
In Stock
|
Shenzhen |
Inquiry |
| 0.25g |
>95% |
1
In Stock
|
Shanghai |
Inquiry |
| 1g |
>95% |
0
Out of Stock
|
Hong Kong |
Inquiry |
282528-30-7 / 2,3-bis(bromomethyl)pyrazine
Standard CAS: 282528-30-7
Multi CAS: No
Basic Information
CAS
282528-30-7
Multi CAS
No
Molecular Formula
C6H6BR2N2
Molecular Weight
265.930000
Exact Mass
265.887720
InChI
InChI=1S/C6H6Br2N2/c7-3-5-6(4-8)10-2-1-9-5/h1-2H,3-4H2
InChIKey
JERYIUNYYNHLAO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
47.29
TPSA
25.78
LogP / Solubility
WLOGP
2.27
MLOGP
2
XLogP3
1
Consensus LogP
1.76
Log S (ESOL)
-3.23
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.38
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.51
Class (SILICOS-IT)
Poorly 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)
-2.73
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5