CAS RN: 2226031-12-3
Dibenzofuran, 4-iodo-6-phenyl-
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.20260101 | 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2226031-12-3
- Purity/Analytical Methods: >99.0%
2226031-12-3 / 4-iodo-6-phenyldibenzofuran
Basic Information
CAS
2226031-12-3
Multi CAS
No
Molecular Formula
C18H11IO
Molecular Weight
370.200000
Exact Mass
369.985460
SMILES
C1=CC=C(C=C1)C2=CC=CC3=C2OC4=C3C=CC=C4I
InChI
InChI=1S/C18H11IO/c19-16-11-5-10-15-14-9-4-8-13(17(14)20-18(15)16)12-6-2-1-3-7-12/h1-11H
InChIKey
JMSGYMFFKLNFTA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
19
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
91.87
TPSA
13.14
LogP / Solubility
WLOGP
5.86
MLOGP
5.18
XLogP3
5.9
Consensus LogP
5.65
Log S (ESOL)
-6.46
Class (ESOL)
Insoluble
Log S (Ali)
-6.82
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.05
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.82
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-5-(2-propyn-1-yloxy)-
- CAS RN: 2226303-74-6
- Product Code: SSC-107311
-
Methy1 1-amino-3-(benzyloxy)-4-oxo-1,4-dihydropyridine-2-carboxylate
- CAS RN: 2226366-36-3
- Product Code: starshine_CAS2226366-36-3
- Purity/Analytical method: >99.0%
-
(S)-N-[1-(Dimethylamino)-3-phenyl-2-propyl]acetamide
- CAS RN: 2226371-98-6
- Product Code: SSC-107318
-
2-Bromo-4,8-bis((2-octyldodecyl)oxy)benzo[1,2-b:4,5-b’]dithiophene
- CAS RN: 2226388-08-3
- Product Code: starshine_CAS2226388-08-3
- Purity/Analytical method: >99.0%
-
-
5-([2,2′:6′,2”-terpyridin]-4′-yl)isophthalic acid
- CAS RN: 2226465-62-7
- Product Code: starshine_CAS2226465-62-7
- Purity/Analytical method: >99.0%
![CAS 2226371-98-6 (S)-N-[1-(Dimethylamino)-3-phenyl-2-propyl]acetamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2226371-98-6.gif)
![CAS 2226388-08-3 2-Bromo-4,8-bis((2-octyldodecyl)oxy)benzo[1,2-b:4,5-b’]dithiophene molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2226388-08-3.gif)
![CAS 2226465-62-7 5-([2,2′:6′,2”-terpyridin]-4′-yl)isophthalic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2226465-62-7.gif)