![CAS 1268621-99-3 N-([1,1′-Biphenyl]-4-yl)-N-(4′-bromo-[1,1′-biphenyl]-4-yl)-9,9-dimethyl-9H-fluoren-2-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5719-jpgcontextbwfzdgvyfhjvb3r8ndawnjd8aw1hz2uvanblz3xoodcvadlmlzg5mjkymtq1mjk1njyvqju3mtkuanbnfdixntllmgnhn2e2otbimgzhzjzhzjm2ngu2ndq2mzm3ngi4y2njndq1ywizywq1ndvjnjqxmgi4yjg1yzcwnme.jpeg)
CAS RN: 1268621-99-3
N-([1,1′-Biphenyl]-4-yl)-N-(4′-bromo-[1,1′-biphenyl]-4-yl)-9,9-dimethyl-9H-fluoren-2-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.20260427 | 1g / 5g / 25g | Out of stock | 15 business days | Inquiry |
- Product code: SSC-034127
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: 5g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
1268621-99-3 / N-[4-(4-bromophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
Basic Information
CAS
1268621-99-3
Multi CAS
No
Molecular Formula
C39H30BrN
Molecular Weight
592.600000
Exact Mass
591.156160
SMILES
CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=C(C=C4)C5=CC=CC=C5)C6=CC=C(C=C6)C7=CC=C(C=C7)Br)C
InChI
InChI=1S/C39H30BrN/c1-39(2)37-11-7-6-10-35(37)36-25-24-34(26-38(36)39)41(32-20-14-29(15-21-32)27-8-4-3-5-9-27)33-22-16-30(17-23-33)28-12-18-31(40)19-13-28/h3-26H,1-2H3
InChIKey
BVGHBDVZNITQRN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
41
Aromatic heavy atom count
36
Fraction Csp3
0.08
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
177.26
TPSA
3.24
LogP / Solubility
WLOGP
11.56
MLOGP
10.22
XLogP3
11.6
Consensus LogP
11.13
Log S (ESOL)
-11.12
Class (ESOL)
Insoluble
Log S (Ali)
-12.76
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.71
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)
1.87
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6
