CAS RN: 474432-60-5

Pyrazolo[1,5-a]pyridine-6-carboxaldehyde (9CI)

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  • Product code: starshine_CAS474432-60-5
  • Purity/Analytical Methods: >99.0%
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474432-60-5 / pyrazolo[1,5-a]pyridine-6-carbaldehyde

Standard CAS: 474432-60-5 Multi CAS: No

Basic Information

CAS
474432-60-5
Multi CAS
No
Molecular Formula
C8H6N2O
Molecular Weight
146.150000
Exact Mass
146.048013
InChI
InChI=1S/C8H6N2O/c11-6-7-1-2-8-3-4-9-10(8)5-7/h1-6H
InChIKey
AYWFMERVJDICFE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
40.58
TPSA
34.37

LogP / Solubility

WLOGP
1.15
MLOGP
1
XLogP3
0.5
Consensus LogP
0.88
Log S (ESOL)
-2.01
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.59
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.68
Class (SILICOS-IT)
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)
-2.8

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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