![CAS 17412-26-9 2H-PYRIMIDO[1,2-B]PYRIDAZIN, 2-CHLORO-7,8-DIMETHYL- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/17412-26-9.gif)
CAS RN: 17412-26-9
2H-PYRIMIDO[1,2-B]PYRIDAZIN, 2-CHLORO-7,8-DIMETHYL-
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.20250123 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS17412-26-9
- Purity/Analytical Methods: >99.0%
17412-26-9 / 6-chloro-2,3-dimethylimidazo[1,2-b]pyridazine
Basic Information
CAS
17412-26-9
Multi CAS
No
Molecular Formula
C8H8ClN3
Molecular Weight
181.620000
Exact Mass
181.040675
SMILES
CC1=C(N2C(=N1)C=CC(=N2)Cl)C
InChI
InChI=1S/C8H8ClN3/c1-5-6(2)12-8(10-5)4-3-7(9)11-12/h3-4H,1-2H3
InChIKey
HLRWSGWOBOHHGY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.25
H-bond acceptors
3
Molar refractivity
47.47
TPSA
30.19
LogP / Solubility
WLOGP
2
MLOGP
1.76
XLogP3
2.1
Consensus LogP
1.95
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.49
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.5
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)
-2.41
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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ARISTOLOCHIC ACID D(RG)(PLEASE CALL)
- CAS RN: 17413-38-6
- Product Code: starshine_CAS17413-38-6
- Purity/Analytical method: >99.0%
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2-(2-CHLOROPHENOXY)-2-METHYLPROPIONICACID
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- Purity/Analytical method: >99.0%
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