![CAS 2703752-88-7 methyl 4,6-dichloroH-pyrazolo[1,5-a]pyridine-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2703752-88-7.gif)
CAS RN: 2703752-88-7
methyl 4,6-dichloroH-pyrazolo[1,5-a]pyridine-3-carboxylate
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250119 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS2703752-88-7
- Purity/Analytical Methods: >99.0%
2703752-88-7 / methyl 4,6-dichloropyrazolo[1,5-a]pyridine-3-carboxylate
Basic Information
CAS
2703752-88-7
Multi CAS
No
Molecular Formula
C9H6Cl2N2O2
Molecular Weight
245.060000
Exact Mass
243.980633
SMILES
COC(=O)C1=C2C(=CC(=CN2N=C1)Cl)Cl
InChI
InChI=1S/C9H6Cl2N2O2/c1-15-9(14)6-3-12-13-4-5(10)2-7(11)8(6)13/h2-4H,1H3
InChIKey
YBSCVHOSHOOEQP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
56.55
TPSA
43.6
LogP / Solubility
WLOGP
2.43
MLOGP
2.14
XLogP3
2.2
Consensus LogP
2.26
Log S (ESOL)
-3.27
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.32
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
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)
-2.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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