CAS RN: 60770-67-4
5-Iodobenzofuran
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251121 | 100mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS60770-67-4
- Purity/Analytical Methods: >99.0%
60770-67-4 / 5-iodo-1-benzofuran
Basic Information
CAS
60770-67-4
Multi CAS
No
Molecular Formula
C8H5IO
Molecular Weight
244.030000
Exact Mass
243.938510
InChI
InChI=1S/C8H5IO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChIKey
LNRVLSJOGUTLDU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
1
Molar refractivity
48.93
TPSA
13.14
LogP / Solubility
WLOGP
3.04
MLOGP
2.68
XLogP3
3
Consensus LogP
2.91
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.75
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.77
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)
-2.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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