![CAS 2360856-05-7 6-chloro-1-methyl-pyrazolo[3,4-b]pyridine-3-carbonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2360856-05-7.gif)
CAS RN: 2360856-05-7
6-chloro-1-methyl-pyrazolo[3,4-b]pyridine-3-carbonitrile
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.20260217 | 100mg / 250mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2360856-05-7
- Purity/Analytical Methods: >99.0%
2360856-05-7 / 6-chloro-1-methylpyrazolo[3,4-b]pyridine-3-carbonitrile
Basic Information
CAS
2360856-05-7
Multi CAS
No
Molecular Formula
C8H5ClN4
Molecular Weight
192.600000
Exact Mass
192.020274
SMILES
CN1C2=C(C=CC(=N2)Cl)C(=N1)C#N
InChI
InChI=1S/C8H5ClN4/c1-13-8-5(6(4-10)12-13)2-3-7(9)11-8/h2-3H,1H3
InChIKey
UCVFTENSRFIRLA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
4
Molar refractivity
48.23
TPSA
54.5
LogP / Solubility
WLOGP
1.49
MLOGP
1.31
XLogP3
1.8
Consensus LogP
1.53
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.22
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.15
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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![CAS 2361069-97-6 Palladium, [2-[2-(amino-κN)ethyl]phenyl-κC][[2′,6′-bis(1-methylethoxy)[1,1′-biphenyl]-2-yl]dicyclohexylphosphine-κP]chloro-, (SP-4-4)-, compd. with 2-methoxy-2-methylpropane (1:1) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2361069-97-6.gif)
