![CAS 1346808-65-8 3-fluoro-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1346808-65-8.gif)
CAS RN: 1346808-65-8
3-fluoro-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine hydrochloride
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.20251215 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-042610
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 | Shenzhen | Inquiry |
1346808-65-8 / 3-fluoro-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine;hydrochloride
Basic Information
CAS
1346808-65-8
Multi CAS
No
Molecular Formula
C7H8ClFN2
Molecular Weight
174.600000
Exact Mass
174.036004
SMILES
C1C2=C(CN1)N=CC(=C2)F.Cl
InChI
InChI=1S/C7H7FN2.ClH/c8-6-1-5-2-9-4-7(5)10-3-6;/h1,3,9H,2,4H2;1H
InChIKey
VXFYNBRFDPWNKL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.29
H-bond acceptors
2
H-bond donors
1
Molar refractivity
41.99
TPSA
24.92
LogP / Solubility
WLOGP
1.25
MLOGP
1.09
XLogP3
1.25
Consensus LogP
1.2
Log S (ESOL)
-2.11
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.83
Class (SILICOS-IT)
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)
-2.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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