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CAS 19195-46-1 [1,2,4]Triazolo[4,3-b]pyridazin-6-amine molecular structure lightbox
CAS RN: 19195-46-1

[1,2,4]Triazolo[4,3-b]pyridazin-6-amine

  • Product code: SSC-089880
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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 19195-46-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

19195-46-1 / [1,2,4]triazolo[4,3-b]pyridazin-6-amine

Standard CAS: 19195-46-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
19195-46-1
Multi CAS
No
Molecular Formula
C5H5N5
Molecular Weight
135.130000
Exact Mass
135.054495
SMILES
C1=CC2=NN=CN2N=C1N
InChI
InChI=1S/C5H5N5/c6-4-1-2-5-8-7-3-10(5)9-4/h1-3H,(H2,6,9)
InChIKey
LWSNTUJMYIJVMO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
5
H-bond donors
1
Molar refractivity
35.19
TPSA
69.1

LogP / Solubility

WLOGP
-0.29
MLOGP
-0.27
XLogP3
-0.6
Consensus LogP
-0.39
Log S (ESOL)
-1.16
Class (ESOL)
Soluble
Log S (Ali)
-0.46
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.29
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)
-3.75

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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