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CAS 1206976-02-4 1H-Pyrazolo[4,3-c]pyridine-6-aMine molecular structure lightbox
CAS RN: 1206976-02-4

1H-Pyrazolo[4,3-c]pyridine-6-aMine

  • Product code: SSC-021815
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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: ≥95%
  • 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 1206976-02-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1206976-02-4 / 1H-pyrazolo[4,3-c]pyridin-6-amine

1H-Pyrazolo[4,3-c]pyridin-6-amine | 1H-Pyrazolo[4,3-c]pyridine-6-amine | MFCD17010075

Standard CAS: 1206976-02-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1206976-02-4
Multi CAS
No
Molecular Formula
C6H6N4
Molecular Weight
134.140000
Exact Mass
134.059246
SMILES
C1=C2C(=CN=C1N)C=NN2
InChI
InChI=1S/C6H6N4/c7-6-1-5-4(2-8-6)3-9-10-5/h1-3H,(H2,7,8)(H,9,10)
InChIKey
MICAWGSNBAKABL-UHFFFAOYSA-N
Synonyms
1H-Pyrazolo[4,3-c]pyridin-6-amine 1H-Pyrazolo[4,3-c]pyridine-6-amine MFCD17010075 SCHEMBL14675971 SCHEMBL14675972

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
3
H-bond donors
2
Molar refractivity
38.3
TPSA
67.59

LogP / Solubility

WLOGP
0.54
MLOGP
0.47
XLogP3
0.1
Consensus LogP
0.37
Log S (ESOL)
-1.68
Class (ESOL)
Soluble
Log S (Ali)
-1.05
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.98
Class (SILICOS-IT)
Very 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)
-3.15

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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