CAS RN: 1185313-93-2
3-Chloro-6-(piperidin-3-yloxy)-pyridazine hydrochloride
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.20250411 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185313-93-2
- Purity/Analytical Methods: >99.0%
1185313-93-2 / 3-chloro-6-piperidin-3-yloxypyridazine;hydrochloride
3-chloro-6-(piperidin-3-yloxy)pyridazine hydrochloride | 3-Chloro-6-(piperidin-3-yloxy)-pyridazine hydrochloride | 3-chloro-6-piperidin-3-yloxypyridazine;hydrochloride
Basic Information
CAS
1185313-93-2
Multi CAS
Yes
Molecular Formula
C9H13Cl2N3O
Molecular Weight
250.120000
Exact Mass
249.043567
SMILES
C1CC(CNC1)OC2=NN=C(C=C2)Cl.Cl
InChI
InChI=1S/C9H12ClN3O.ClH/c10-8-3-4-9(13-12-8)14-7-2-1-5-11-6-7;/h3-4,7,11H,1-2,5-6H2;1H
InChIKey
CTQVKSVNAAEZDH-UHFFFAOYSA-N
Synonyms
3-chloro-6-(piperidin-3-yloxy)pyridazine hydrochloride
3-Chloro-6-(piperidin-3-yloxy)-pyridazine hydrochloride
3-chloro-6-piperidin-3-yloxypyridazine;hydrochloride
SBB075335
AKOS015941181
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
60.81
TPSA
47.04
LogP / Solubility
WLOGP
1.68
MLOGP
1.49
XLogP3
1.68
Consensus LogP
1.62
Log S (ESOL)
-2.61
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.83
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.92
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
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