CAS RN: 2446590-67-4
2,3-Dimethyl-6-amino-2H-indazole (dihydrochloride)
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.20250128 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2446590-67-4
- Purity/Analytical Methods: >99.0%
2446590-67-4 / 2,3-dimethylindazol-6-amine;dihydrochloride
Basic Information
CAS
2446590-67-4
Multi CAS
No
Molecular Formula
C9H13Cl2N3
Molecular Weight
234.120000
Exact Mass
233.048653
SMILES
CC1=C2C=CC(=CC2=NN1C)N.Cl.Cl
InChI
InChI=1S/C9H11N3.2ClH/c1-6-8-4-3-7(10)5-9(8)11-12(6)2;;/h3-5H,10H2,1-2H3;2*1H
InChIKey
FMCFATCZUACZQS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.22
H-bond acceptors
3
H-bond donors
1
Molar refractivity
64.36
TPSA
43.84
LogP / Solubility
WLOGP
2.31
MLOGP
2.03
XLogP3
2.31
Consensus LogP
2.22
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.15
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.1
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.51
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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