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CAS 1134307-94-0 4-AMino-7-azaindole hydro… molecular structure lightbox
CAS RN: 1134307-94-0

4-AMino-7-azaindole hydro…

  • Product code: SSC-013554
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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: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1134307-94-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1134307-94-0 / 1H-pyrrolo[2,3-b]pyridin-4-amine;hydrochloride

1H-pyrrolo[2,3-b]pyridin-4-amine hydrochloride | 4-Amino-7-azaindole hydrochloride | MFCD08689965

Standard CAS: 1134307-94-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1134307-94-0
Multi CAS
Yes
Molecular Formula
C7H8ClN3
Molecular Weight
169.610000
Exact Mass
169.040675
SMILES
C1=CNC2=NC=CC(=C21)N.Cl
InChI
InChI=1S/C7H7N3.ClH/c8-6-2-4-10-7-5(6)1-3-9-7;/h1-4H,(H3,8,9,10);1H
InChIKey
AZAKGDZCTHXHFX-UHFFFAOYSA-N
Synonyms
1H-pyrrolo[2,3-b]pyridin-4-amine hydrochloride 4-Amino-7-azaindole hydrochloride MFCD08689965 4-AMINO-7-AZAINDOLE HCL 1H-Pyrrolo[2,3-b]pyridin-4-amine, hydrochloride (1:1)

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
47.75
TPSA
54.7

LogP / Solubility

WLOGP
1.57
MLOGP
1.38
XLogP3
1.57
Consensus LogP
1.51
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.08
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.06
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)
-2.64

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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