![CAS 2205054-16-4 N,N-Bis(4-bromophenyl)-[1,1′:4′,1”-terphenyl]-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b6126-jpgcontextbwfzdgvyfhjvb3r8mzi1mzz8aw1hz2uvanblz3xootkvage3lzg5mjkynjqzmzy5mjyvqjyxmjyuanbnfgjjnmfjyzaynjq2odrmmze4odllmzczyjbhogewnzywmzrjn2zmzwvimddmmtqznjkymtdkzwu3m2rimwuznzm.jpeg)
CAS RN: 2205054-16-4
N,N-Bis(4-bromophenyl)-[1,1′:4′,1”-terphenyl]-4-amine
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.20250112 | 1g | In stock | Shanghai | Inquiry |
- Product code: SSC-106090
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
2205054-16-4 / N,N-bis(4-bromophenyl)-4-(4-phenylphenyl)aniline
Basic Information
CAS
2205054-16-4
Multi CAS
No
Molecular Formula
C30H21Br2N
Molecular Weight
555.300000
Exact Mass
555.002030
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br
InChI
InChI=1S/C30H21Br2N/c31-26-12-18-29(19-13-26)33(30-20-14-27(32)15-21-30)28-16-10-25(11-17-28)24-8-6-23(7-9-24)22-4-2-1-3-5-22/h1-21H
InChIKey
YNNZUIKXDANVDW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
30
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
147.4
TPSA
3.24
LogP / Solubility
WLOGP
10.02
MLOGP
8.86
XLogP3
9.8
Consensus LogP
9.56
Log S (ESOL)
-9.94
Class (ESOL)
Insoluble
Log S (Ali)
-11.34
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.18
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
3.5
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