![CAS 1159827-76-5 IMidazo[1,2-a]pyridine-3-carboxylic acid, 7-fluoro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1159827-76-5.gif)
CAS RN: 1159827-76-5
IMidazo[1,2-a]pyridine-3-carboxylic acid, 7-fluoro-
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
- Product code: SSC-015934
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 0.25g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.25g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
1159827-76-5 / 7-fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
7-Fluoroimidazo[1,2-a]pyridine-3-carboxylic acid | MFCD12401268 | Imidazo[1,2-a]pyridine-3-carboxylic acid, 7-fluoro-
Basic Information
CAS
1159827-76-5
Multi CAS
No
Molecular Formula
C8H5FN2O2
Molecular Weight
180.140000
Exact Mass
180.033506
SMILES
C1=CN2C(=NC=C2C(=O)O)C=C1F
InChI
InChI=1S/C8H5FN2O2/c9-5-1-2-11-6(8(12)13)4-10-7(11)3-5/h1-4H,(H,12,13)
InChIKey
DEZSHNQMIWONQE-UHFFFAOYSA-N
Synonyms
7-Fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
MFCD12401268
Imidazo[1,2-a]pyridine-3-carboxylic acid, 7-fluoro-
SCHEMBL2051117
DEZSHNQMIWONQE-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
42.11
TPSA
54.6
LogP / Solubility
WLOGP
1.17
MLOGP
1.03
XLogP3
1.7
Consensus LogP
1.3
Log S (ESOL)
-2.14
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.88
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.92
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)
-2.99
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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