CAS RN: 820245-53-2

IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID HYDROBROMIDE

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Batchno.20260501 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS820245-53-2
  • Purity/Analytical Methods: >99.0%
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820245-53-2 / imidazo[1,2-a]pyridine-2-carboxylic acid;hydrobromide

Standard CAS: 820245-53-2 Multi CAS: No

Basic Information

CAS
820245-53-2
Multi CAS
No
Molecular Formula
BC8H7O2Rn2
Molecular Weight
243.060000
Exact Mass
241.969090
InChI
InChI=1S/C8H6N2O2.BrH/c11-8(12)6-5-10-4-2-1-3-7(10)9-6;/h1-5H,(H,11,12);1H
InChIKey
UBSBABRHGOKSSX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.47
TPSA
54.6

LogP / Solubility

WLOGP
1.61
MLOGP
1.42
XLogP3
1.61
Consensus LogP
1.55
Log S (ESOL)
-2.81
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.7
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)
-3.06

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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