CAS RN: 1427501-80-1

4,6-DICHLOROPYRAZOLO[1,5-A]PYRIDINE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260108 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1427501-80-1
  • Purity/Analytical Methods: >99.0%
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1427501-80-1 / 4,6-dichloropyrazolo[1,5-a]pyridine

Standard CAS: 1427501-80-1 Multi CAS: No

Basic Information

CAS
1427501-80-1
Multi CAS
No
Molecular Formula
C7H4Cl2N2
Molecular Weight
187.020000
Exact Mass
185.975154
SMILES
C1=C2C(=CC(=CN2N=C1)Cl)Cl
InChI
InChI=1S/C7H4Cl2N2/c8-5-3-6(9)7-1-2-10-11(7)4-5/h1-4H
InChIKey
UTXPDPIIVRGLFE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
45.21
TPSA
17.3

LogP / Solubility

WLOGP
2.64
MLOGP
2.32
XLogP3
2.3
Consensus LogP
2.42
Log S (ESOL)
-3.27
Class (ESOL)
Poorly soluble
Log S (Ali)
-3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.07
Class (SILICOS-IT)
Poorly 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)
-1.99

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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