![CAS 1256801-93-0 4,6-dichloro-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1256801-93-0.gif)
CAS RN: 1256801-93-0
4,6-dichloro-3-(trifluoromethyl)-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.20250105 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: SSC-030692
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 | Shanghai | Inquiry |
1256801-93-0 / 4,6-dichloro-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine
Basic Information
CAS
1256801-93-0
Multi CAS
No
Molecular Formula
C8H3Cl2F3N2
Molecular Weight
255.020000
Exact Mass
253.962538
SMILES
C1=C(C2=C(NC=C2C(F)(F)F)N=C1Cl)Cl
InChI
InChI=1S/C8H3Cl2F3N2/c9-4-1-5(10)15-7-6(4)3(2-14-7)8(11,12)13/h1-2H,(H,14,15)
InChIKey
TXPTXMVVDABNAN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
1
H-bond donors
1
Molar refractivity
51.12
TPSA
28.68
LogP / Solubility
WLOGP
3.89
MLOGP
3.43
XLogP3
3.8
Consensus LogP
3.71
Log S (ESOL)
-4.31
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.46
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.55
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.51
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 1256802-03-5 1H-Pyrazolo[4,3-c]pyridine-6-carboxylic acid molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
1H-Pyrazolo[4,3-c]pyridine-6-carboxylic acid
- CAS RN: 1256802-03-5
- Product Code: SSC-030693
-
4-chloro-3-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine(WXFC0588)
- CAS RN: 1256802-09-1
- Product Code: SSC-030694
-
4-Pyridinecarboxylic acid, 3-hydroxy-2-methoxy-
- CAS RN: 1256802-56-8
- Product Code: SSC-030695
-
5-fluoro-6-(trifluoromethyl)pyridine-2-carboxylic acid
- CAS RN: 1256802-73-9
- Product Code: SSC-030696
-
5-Chloro-3-Methyl-7-azaindole
- CAS RN: 1256803-09-4
- Product Code: starshine_CAS1256803-09-4
- Purity/Analytical method: >99.0%
-
![CAS 1256802-03-5 1H-Pyrazolo[4,3-c]pyridine-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1256802-03-5.gif)
![CAS 1256802-09-1 4-chloro-3-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine(WXFC0588) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1256802-09-1.gif)
