![CAS 159045-50-8 Imidazo[1,2-b]pyridazine-6-carboxamide (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/159045-50-8.gif)
CAS RN: 159045-50-8
Imidazo[1,2-b]pyridazine-6-carboxamide (9CI)
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.20260511 | 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS159045-50-8
- Purity/Analytical Methods: >99.0%
159045-50-8 / imidazo[1,2-b]pyridazine-6-carboxamide
Basic Information
CAS
159045-50-8
Multi CAS
No
Molecular Formula
C7H6N4O
Molecular Weight
162.150000
Exact Mass
162.054161
SMILES
C1=CC2=NC=CN2N=C1C(=O)N
InChI
InChI=1S/C7H6N4O/c8-7(12)5-1-2-6-9-3-4-11(6)10-5/h1-4H,(H2,8,12)
InChIKey
XAJFVAXIKGCIMT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
41.5
TPSA
73.28
LogP / Solubility
WLOGP
-0.17
MLOGP
-0.16
XLogP3
-0.5
Consensus LogP
-0.28
Log S (ESOL)
-1.23
Class (ESOL)
Soluble
Log S (Ali)
-0.77
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.69
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)
-3.83
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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