CAS RN: 50738-59-5
4,5-d’>diimidazole
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.20251227 | 25mg / 100mg / 250mg / 1g | Confirm by inquiry | Shanghai, Hebei | Inquiry |
- Product code: starshine_CAS50738-59-5
- Purity/Analytical Methods: >99.0%
50738-59-5 / 3,5-dihydroimidazo[4,5-f]benzimidazole
Basic Information
CAS
50738-59-5
Multi CAS
No
Molecular Formula
C8H6N4
Molecular Weight
158.160000
Exact Mass
158.059246
InChI
InChI=1S/C8H6N4/c1-5-7(11-3-9-5)2-8-6(1)10-4-12-8/h1-4H,(H,9,11)(H,10,12)
InChIKey
RFUSHWIUDIMSGP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
12
H-bond acceptors
2
H-bond donors
2
Molar refractivity
45.75
TPSA
57.36
LogP / Solubility
WLOGP
1.44
MLOGP
1.26
XLogP3
1.1
Consensus LogP
1.27
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.9
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.88
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)
-2.66
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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[2,2′-Bifuran]-5,5′-dicarboxylic acid
- CAS RN: 50738-83-5
- Product Code: starshine_CAS50738-83-5
- Purity/Analytical method: >99.0%
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![CAS 50738-83-5 [2,2′-Bifuran]-5,5′-dicarboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/50738-83-5.gif)
