![CAS 1092580-04-5 5-Bromo-4-iodo-1H-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1092580-04-5.gif)
CAS RN: 1092580-04-5
5-Bromo-4-iodo-1H-pyrrolo[2,3-b]pyridine
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.20260305 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: SSC-010503
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1092580-04-5 / 5-bromo-4-iodo-1H-pyrrolo[2,3-b]pyridine
5-Bromo-4-iodo-1H-pyrrolo[2,3-b]pyridine | MFCD13193527 | 1H-Pyrrolo[2,3-b]pyridine, 5-bromo-4-iodo-
Basic Information
CAS
1092580-04-5
Multi CAS
No
Molecular Formula
C7H4BrIN2
Molecular Weight
322.930000
Exact Mass
321.860260
SMILES
C1=CNC2=NC=C(C(=C21)I)Br
InChI
InChI=1S/C7H4BrIN2/c8-5-3-11-7-4(6(5)9)1-2-10-7/h1-3H,(H,10,11)
InChIKey
WJZKOWKFWMBLLY-UHFFFAOYSA-N
Synonyms
5-Bromo-4-iodo-1H-pyrrolo[2,3-b]pyridine
MFCD13193527
1H-Pyrrolo[2,3-b]pyridine, 5-bromo-4-iodo-
5-Bromo-4-iodo-7-azaindole
SCHEMBL1565120
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
56.51
TPSA
28.68
LogP / Solubility
WLOGP
2.93
MLOGP
2.59
XLogP3
2.7
Consensus LogP
2.74
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.32
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.19
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
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
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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