![CAS 1219127-01-1 IMidazo[1,2-a]pyridine, 6-fluoro-3-iodo- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1219127-01-1.gif)
CAS RN: 1219127-01-1
IMidazo[1,2-a]pyridine, 6-fluoro-3-iodo-
Product Availability
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1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250821 | 100mg / 250mg / 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS1219127-01-1
- Purity/Analytical Methods: >99.0%
1219127-01-1 / 6-fluoro-3-iodoimidazo[1,2-a]pyridine
Basic Information
CAS
1219127-01-1
Multi CAS
No
Molecular Formula
C7H4FIN2
Molecular Weight
262.020000
Exact Mass
261.940320
SMILES
C1=CC2=NC=C(N2C=C1F)I
InChI
InChI=1S/C7H4FIN2/c8-5-1-2-7-10-3-6(9)11(7)4-5/h1-4H
InChIKey
JQASPOWSYWAGEP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
47.87
TPSA
17.3
LogP / Solubility
WLOGP
2.08
MLOGP
1.84
XLogP3
2.5
Consensus LogP
2.14
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.21
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.09
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)
-2.84
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501
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