CAS RN: 1388069-08-6
2-Bromo-4-chloro-1H-benzoimidazole
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260129 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250324 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260528 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251124 | 2g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20260513 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1388069-08-6
- Purity/Analytical Methods: >99.0%
1388069-08-6 / 2-bromo-4-chloro-1H-benzimidazole
Basic Information
CAS
1388069-08-6
Multi CAS
No
Molecular Formula
C7H4BrClN2
Molecular Weight
231.480000
Exact Mass
229.924640
SMILES
C1=CC2=C(C(=C1)Cl)N=C(N2)Br
InChI
InChI=1S/C7H4BrClN2/c8-7-10-5-3-1-2-4(9)6(5)11-7/h1-3H,(H,10,11)
InChIKey
SDGHEODVCAKCMY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.8
TPSA
28.68
LogP / Solubility
WLOGP
2.98
MLOGP
2.63
XLogP3
3.1
Consensus LogP
2.9
Log S (ESOL)
-3.76
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.61
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
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)
-2.02
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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