![CAS 25660-12-2 [1,1′:4′,1”:4”,1”’-Quaterphenyl]-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/25660-12-2.gif)
CAS RN: 25660-12-2
[1,1′:4′,1”:4”,1”’-Quaterphenyl]-4-amine
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.20260520 | 50mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS25660-12-2
- Purity/Analytical Methods: >99.0%
25660-12-2 / 4-[4-(4-phenylphenyl)phenyl]aniline
Basic Information
CAS
25660-12-2
Multi CAS
No
Molecular Formula
C24H19N
Molecular Weight
321.400000
Exact Mass
321.151750
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N
InChI
InChI=1S/C24H19N/c25-24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-17H,25H2
InChIKey
WVMMWAWDYFKKCC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
107.16
TPSA
26.02
LogP / Solubility
WLOGP
6.27
MLOGP
5.53
XLogP3
6.1
Consensus LogP
5.97
Log S (ESOL)
-6.3
Class (ESOL)
Insoluble
Log S (Ali)
-6.72
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.31
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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