CAS RN: 663171-12-8
2-bromo-1-ethyl-1H-imidazole(SALTDATA: HCl 0.03C6H14)
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.20260407 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS663171-12-8
- Purity/Analytical Methods: >99.0%
663171-12-8 / 2-bromo-1-ethylimidazole
Basic Information
CAS
663171-12-8
Multi CAS
Yes
Molecular Formula
BC5H7Rn2
Molecular Weight
175.030000
Exact Mass
173.979260
InChI
InChI=1S/C5H7BrN2/c1-2-8-4-3-7-5(8)6/h3-4H,2H2,1H3
InChIKey
KRTIATFLKKNABS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
35.6
TPSA
17.82
LogP / Solubility
WLOGP
1.67
MLOGP
1.46
XLogP3
1.3
Consensus LogP
1.48
Log S (ESOL)
-2.37
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.2
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.3
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)
-2.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
11-Azidoundecyltriethoxysilane
- CAS RN: 663171-33-3
- Product Code: starshine_CAS663171-33-3
- Purity/Analytical method: >99.0%
-
3-tosyl-3-azabicyclo[3.2.0]heptan-6-ol
- CAS RN: 663172-75-6
- Product Code: starshine_CAS663172-75-6
- Purity/Analytical method: >99.0%
-
tert-butyl 6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylate
- CAS RN: 663172-78-9
- Product Code: SSC-175962
-
tert-butyl 6-oxo-3-aza-bicyclo[3.2.0]heptane-3-carboxylate
- CAS RN: 663172-80-3
- Product Code: SSC-175963
-
methyl 3′,5′-dibromo-[1,1′-biphenyl]-4-carboxylate
- CAS RN: 663180-98-1
- Product Code: SSC-175966
-
![CAS 663172-75-6 3-tosyl-3-azabicyclo[3.2.0]heptan-6-ol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/663172-75-6.gif)
![CAS 663172-78-9 tert-butyl 6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/663172-78-9.gif)
![CAS 663172-80-3 tert-butyl 6-oxo-3-aza-bicyclo[3.2.0]heptane-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/663172-80-3.gif)
![CAS 663180-98-1 methyl 3′,5′-dibromo-[1,1′-biphenyl]-4-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/663180-98-1.gif)
