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CAS 96428-16-9 8-BENZYLOXY-IMIDAZO[1,2-A]PYRIDINE molecular structure lightbox
CAS RN: 96428-16-9

8-BENZYLOXY-IMIDAZO[1,2-A]PYRIDINE

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4 package records3 with current stock2 grade groups
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Batchno.20250911 1g In stock Inquiry
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  • Product code: starshine_CAS96428-16-9
  • Purity/Analytical Methods: >99.0%
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96428-16-9 / 8-phenylmethoxyimidazo[1,2-a]pyridine

Standard CAS: 96428-16-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
96428-16-9
Multi CAS
No
Molecular Formula
C14H12N2O
Molecular Weight
224.260000
Exact Mass
224.094963
InChI
InChI=1S/C14H12N2O/c1-2-5-12(6-3-1)11-17-13-7-4-9-16-10-8-15-14(13)16/h1-10H,11H2
InChIKey
LDJVMJRATISVRW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
15
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
65.97
TPSA
26.53

LogP / Solubility

WLOGP
2.91
MLOGP
2.57
XLogP3
3.2
Consensus LogP
2.89
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.5
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.9
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)
-2.02

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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