![CAS 1020038-42-9 IMidazo[1,2-a]pyridine-2-carboxylic acid, 7-chloro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1020038-42-9.gif)
CAS RN: 1020038-42-9
IMidazo[1,2-a]pyridine-2-carboxylic acid, 7-chloro-
Product Availability
Choose a grade to view its available package options.
2 package records1 with current stock1 grade group
- Product code: SSC-003220
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: 1g
- Available purity: ＞95%
- 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 |
|---|---|---|---|---|
| 1g | ＞95% | 0 Out of Stock | Beijing | Inquiry |
1020038-42-9 / 7-chloroimidazo[1,2-a]pyridine-2-carboxylic acid
4-Chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid | DTXSID80649815 | 4-Chloro-1H-pyrrolo(2,3-b)pyridine-5-carboxylic acid
Basic Information
CAS
1020038-42-9
Multi CAS
Yes
Molecular Formula
C8H5ClN2O2
Molecular Weight
196.590000
Exact Mass
196.003955
SMILES
C1=CN2C=C(N=C2C=C1Cl)C(=O)O
InChI
InChI=1S/C8H5ClN2O2/c9-5-1-2-11-4-6(8(12)13)10-7(11)3-5/h1-4H,(H,12,13)
InChIKey
BEFUOITXMHRTRQ-UHFFFAOYSA-N
Synonyms
4-Chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
DTXSID80649815
4-Chloro-1H-pyrrolo(2,3-b)pyridine-5-carboxylic acid
RefChem:291339
DTXCID60600565
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
47.16
TPSA
54.6
LogP / Solubility
WLOGP
1.69
MLOGP
1.48
XLogP3
2.2
Consensus LogP
1.79
Log S (ESOL)
-2.57
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
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)
-2.72
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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