CAS RN: 83266-97-1
4-(4′-aminophenyl)-2,6-bis(4”-aminophenyl)pyridine
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.20250526 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS83266-97-1
- Purity/Analytical Methods: >99.0%
83266-97-1 / 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]aniline
Basic Information
CAS
83266-97-1
Multi CAS
No
Molecular Formula
C23H20N4
Molecular Weight
352.400000
Exact Mass
352.168797
InChI
InChI=1S/C23H20N4/c24-19-7-1-15(2-8-19)18-13-22(16-3-9-20(25)10-4-16)27-23(14-18)17-5-11-21(26)12-6-17/h1-14H,24-26H2
InChIKey
NOESMJBODNBEAM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
24
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
113.78
TPSA
90.95
LogP / Solubility
WLOGP
4.83
MLOGP
4.27
XLogP3
3.8
Consensus LogP
4.3
Log S (ESOL)
-5.53
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.94
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.32
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.44
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
