![CAS 1788054-66-9 4‐chloro‐2‐iodo‐7‐methyl‐7h‐pyrrolo[2,3‐b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB13032737.gif)
CAS RN: 1788054-66-9
4‐chloro‐2‐iodo‐7‐methyl‐7h‐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.20260311 | 100mg / 250mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-079612
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: ≥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 |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1788054-66-9 / 4-chloro-2-iodo-7-methylpyrrolo[2,3-b]pyridine
Basic Information
CAS
1788054-66-9
Multi CAS
No
Molecular Formula
C8H6ClIN2
Molecular Weight
292.500000
Exact Mass
291.926420
SMILES
CN1C=CC(=C2C1=NC(=C2)I)Cl
InChI
InChI=1S/C8H6ClIN2/c1-12-3-2-6(9)5-4-7(10)11-8(5)12/h2-4H,1H3
InChIKey
JARBWCUJUPXCET-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
2
Molar refractivity
57.56
TPSA
17.82
LogP / Solubility
WLOGP
2.78
MLOGP
2.46
XLogP3
2.3
Consensus LogP
2.51
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.97
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.87
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)
-2.53
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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