![CAS 1159831-07-8 7-Bromo-2-methylimidazo[1,2-a]-pyridine-3-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1159831-07-8.gif)
CAS RN: 1159831-07-8
7-Bromo-2-methylimidazo[1,2-a]-pyridine-3-carboxylic acid
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250823 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1159831-07-8
- Purity/Analytical Methods: >99.0%
1159831-07-8 / 7-bromo-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid
7-Bromo-2-methylimidazo[1,2-a]-pyridine-3-carboxylic acid | 7-Bromo-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid | MFCD11840275
Basic Information
CAS
1159831-07-8
Multi CAS
No
Molecular Formula
C9H7BrN2O2
Molecular Weight
255.070000
Exact Mass
253.969090
SMILES
CC1=C(N2C=CC(=CC2=N1)Br)C(=O)O
InChI
InChI=1S/C9H7BrN2O2/c1-5-8(9(13)14)12-3-2-6(10)4-7(12)11-5/h2-4H,1H3,(H,13,14)
InChIKey
PIYHSBMKGBVADI-UHFFFAOYSA-N
Synonyms
7-Bromo-2-methylimidazo[1,2-a]-pyridine-3-carboxylic acid
7-Bromo-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid
MFCD11840275
SCHEMBL30770769
SBB053561
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
54.59
TPSA
54.6
LogP / Solubility
WLOGP
2.1
MLOGP
1.86
XLogP3
2.7
Consensus LogP
2.22
Log S (ESOL)
-3.16
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.17
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.18
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)
-2.78
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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