![CAS 1159828-70-2 1H-Pyrazolo[4,3-c]pyridine,4-chloro-6-Methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1159828-70-2.gif)
CAS RN: 1159828-70-2
1H-Pyrazolo[4,3-c]pyridine,4-chloro-6-Methyl-
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260503 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS1159828-70-2
- Purity/Analytical Methods: >99.0%
1159828-70-2 / 4-chloro-6-methyl-1H-pyrazolo[4,5-c]pyridine
4-Chloro-6-methyl-1H-pyrazolo[4,3-c]pyridine | MFCD12401562 | 1H-Pyrazolo[4,3-c]pyridine, 4-chloro-6-methyl-
Basic Information
CAS
1159828-70-2
Multi CAS
No
Molecular Formula
C7H6ClN3
Molecular Weight
167.590000
Exact Mass
167.025025
SMILES
CC1=CC2=C(C=NN2)C(=N1)Cl
InChI
InChI=1S/C7H6ClN3/c1-4-2-6-5(3-9-11-6)7(8)10-4/h2-3H,1H3,(H,9,11)
InChIKey
OHSIWTLJMVJMJD-UHFFFAOYSA-N
Synonyms
4-Chloro-6-methyl-1H-pyrazolo[4,3-c]pyridine
MFCD12401562
1H-Pyrazolo[4,3-c]pyridine, 4-chloro-6-methyl-
SCHEMBL2630775
SCHEMBL24737984
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
43.64
TPSA
41.57
LogP / Solubility
WLOGP
1.92
MLOGP
1.69
XLogP3
1.8
Consensus LogP
1.8
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.34
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)
-2.38
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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