![CAS 1170585-19-9 6-Amino-1H-pyrrolo[2,3-b]pyridine dihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1170585-19-9.gif)
CAS RN: 1170585-19-9
6-Amino-1H-pyrrolo[2,3-b]pyridine dihydrochloride
- Product code: SSC-016882
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | >95% | 0 Out of Stock | Shenzhen | Inquiry |
1170585-19-9 / 1H-pyrrolo[2,3-b]pyridin-6-amine;dihydrochloride
6-Amino-7-azaindole dihydrochloride | 1H-Pyrrolo[2,3-b]pyridin-6-amine dihydrochloride | 6-Amino-7-azaindole DiHCl
Basic Information
CAS
1170585-19-9
Multi CAS
Yes
Molecular Formula
C7H9Cl2N3
Molecular Weight
206.070000
Exact Mass
205.017353
SMILES
C1=CC(=NC2=C1C=CN2)N.Cl.Cl
InChI
InChI=1S/C7H7N3.2ClH/c8-6-2-1-5-3-4-9-7(5)10-6;;/h1-4H,(H3,8,9,10);2*1H
InChIKey
PXZDBOQMBYQRNF-UHFFFAOYSA-N
Synonyms
6-Amino-7-azaindole dihydrochloride
1H-Pyrrolo[2,3-b]pyridin-6-amine dihydrochloride
6-Amino-7-azaindole DiHCl
MFCD11035724
1H-pyrrolo[2,3-b]pyridin-6-amine;dihydrochloride
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
55
TPSA
54.7
LogP / Solubility
WLOGP
1.99
MLOGP
1.75
XLogP3
1.99
Consensus LogP
1.91
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.65
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.57
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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